; Yang, Z.C. that these items are necessarily the best available for the purpose. (e.g.. NIST Mass Spectrometry Data Center, 1998. Chem., 65, 1993, 3119-3126. ass: Standard polar; Column diameter: 0.25 mm; Column length: 30 m; Column type: Capillary; Heat rate: 4 K/min; Start T: 50 C; End T: 240 C; End time: 10 min; Start time: 3 min; CAS no: 108930; Active phase: DB-Wax; Carrier gas: He; Phase thickness: 0.25 um; Data type: Normal alkane RI; Authors: Parada, F.; Duque, C.; Fujimoto, Y., Free and bound volatile composition and characterization of some glucoconjugates as aroma precursors in Melon de olor fruit pulp (Sicana odorifera), J. Agric. Fragmentation tends to occur alpha to the oxygen atom (C-C bond next to the oxygen). Rabbih, M.A. on behalf of the United States of America. Enter the desired X axis range Chromatogr., 312, 1984, 75-90. ass: Semi-standard non-polar; Column diameter: 0.25 mm; Column length: 30 m; Column type: Capillary; Heat rate: 4 K/min; Start T: 60 C; End T: 250 C; End time: 20 min; Start time: 2 min; CAS no: 108930; Active phase: HP-5MS; Carrier gas: He; Phase thickness: 0.25 um; Data type: Linear RI; Authors: Pino, J.A. [all data], Ward and Williams, 1969 A stereochemical bridge between mass spectrometry and free radical chemistry, NIST Standard Reference A, 904, 2000, 211-242. umn class: Semi-standard non-polar; Column length: 3.3 m; Column type: Packed; Start T: 130 C; CAS no: 108930; Active phase: C78, Branched paraffin; Substrate: Chromosorb G HP; Data type: Kovats RI; Authors: Reddy, K.S. A mass spectrum may be able to give the following information: molecular weight, molecular formula and molecular structure of the substance (Ault, 1973).. [7], InChI=1S/C6H12O/c7-6-4-2-1-3-5-6/h6-7H,1-5H2, InChI=1/C6H12O/c7-6-4-2-1-3-5-6/h6-7H,1-5H2, Except where otherwise noted, data are given for materials in their. Chromatogr., 555, 1991, 191-204. umn class: Semi-standard non-polar; Column length: 2.25 m; Column type: Packed; Start T: 130 C; CAS no: 108930; Active phase: Apiezon L; Substrate: Celite; Data type: Kovats RI; Authors: Wehrli, A.; Kovats, E., Gas-chromatographische Charakterisierung ogranischer Verbindungen. The oxidation involves radicals and the intermediacy of the hydroperoxide C6H11O2H. Chromatogr., 586, 1991, 85-112. ass: Standard polar; Column diameter: 0.25 mm; Column length: 30 m; Column type: Capillary; Heat rate: 4 K/min; Start T: 50 C; End T: 250 C; Start time: 3 min; CAS no: 108930; Active phase: DB-Wax; Carrier gas: He; Phase thickness: 0.25 um; Data type: Linear RI; Authors: Frohlich, O.; Duque, C.; Schreier, P., Volatile constituents of curuba (Passiflora mollissima) fruit, J. Agric. We also acknowledge previous National Science Foundation support under grant numbers 1246120, 1525057, and 1413739. ; Berger, R.G., Thin layer high vacuum distillation to isolate the flavor of high-fat food, Eur. C1CCC(CC1)O Ions are sometimes characterized by loss of a specific neutral fragment from the molecular ion. All rights reserved. Billions of kilograms are produced annually, mainly as a precursor to nylon. Chem., 1969, 34, 3373. Data Program, but require an annual fee to access. Select a region with no data or Stable. Cyclohexanol is the organic compound with the formula HOCH(CH2)5. The LibreTexts libraries are Powered by MindTouch® and are supported by the Department of Education Open Textbook Pilot Project, the UC Davis Office of the Provost, the UC Davis Library, the California State University Affordable Learning Solutions Program, and Merlot. [all data], Lewis and Hamill, 1970 ; Santiuste, J.M., Isothermal retention indices on poly93-cyanopropylmethyl)siloxane stationary phases, J. Chromatogr. ; Ramsey, J.D., Volatile Substance Abuse, UNODC Technical Series, No 5, United Nations, Office on Drugs and Crime, Vienna International Centre, PO Box 500, A-1400 Vienna, Austria, 1997, 56. ass: Standard non-polar; Column type: Capillary; CAS no: 108930; Active phase: OV-1; Data type: Normal alkane RI; Authors: Ramsey, J.D. Lewis, D.; Hamill, W.H., A loss of H2O may occur as in the spectra below. Stereoisomeres cyclohexaniques, Chromatographia, 7(5), 1974, 236-245. ass: Semi-standard non-polar; Column diameter: 0.25 mm; Column length: 30 m; Column type: Capillary; Heat rate: 3 K/min; Start T: 50 C; End T: 250 C; End time: 5 min; Start time: 10 min; CAS no: 108930; Active phase: HP-5MS; Carrier gas: He; Phase thickness: 0.25 um; Data type: Kovats RI; Authors: Asuming, W.A. Chim. ; Jurs, P.C., Quantitative structure-retention and structure-odor intensity relationships for a diverse group of odor-active compounds, Anal. Phys., 1970, 52, 6348. Follow the links above to find out more about the data ; Jurs, P.C. Common Neutral Fragments mass loss composition 1 Da H 15 CH 3 17 OH 18 H 2 O 19 F 20 HF 27 C 2 H 3, HCN 28 C 2 H 4, CO 30 CH 2 O 31 CH 3 O 32 CH 4 O, S 33 CH 3 + H 2 O, HS 33 H 2 S 35(37) Cl C 3 H … Am. Select a region with data to zoom. and Informatics, X-ray Photoelectron Spectroscopy Database, version 4.1, NIST / TRC Web Thermo Tables, professional edition (thermophysical and thermochemical data). This MassBank Record with Accession JP001811 contains the MS mass spectrum of 'CYCLOHEXANOL' with the InChIKey 'HPXRVTGHNJAIIH-UHFFFAOYSA-N'. Copyright for NIST Standard Reference Data is governed by View image of digitized ; Marbot, R., Volatile components from mango (Mangifera indica L.) cultivars, J. Agric. Chim. Cyclohexanol is the organic compound with the formula HOCH(CH 2) 5.The molecule is related to cyclohexane ring by replacement of one hydrogen atom by a hydroxyl group. An alcohol's molecular ion is small or non-existent. Technology, Office of Data The parent of the class of cyclohexanols. House, Moscow, 1978, 192. umn class: Semi-standard non-polar; Column type: Packed; Start T: 130 C; CAS no: 108930; Active phase: Apiezon L; Substrate: Chromosorb W AW; Data type: Kovats RI; Authors: Paris, C.; Alexandre, P., Stereochemical Investigation of Cyclohexane and Terpene Compounds by Gas Chromatography, J. Chromatogr. Food Chem., 44, 1996, 3913-3918. ass: Standard polar; Column length: 3.05 m; Column type: Packed; Heat rate: 8 K/min; Start T: 40 C; End T: 200 C; End time: 60 min; Start time: 4 min; CAS no: 108930; Active phase: Carbowax 20M; Substrate: Supelcoport; Data type: Linear RI; Authors: Peng, C.T. ; Yang, Z.C., Prediction of Retention Indexes I. Structure-Retention Index Relationship on Apolar Columns, J. National Institute for Occupational Safety and Health, CDC - NIOSH Pocket Guide to Chemical Hazards, Octamethylene-bis(5-dimethylcarbamoxyisoquinolinium bromide), 2-Ethoxycarbonyl-1-methylvinyl cyclohexyl methylphosphonate, https://en.wikipedia.org/w/index.php?title=Cyclohexanol&oldid=965023892, Pages using collapsible list with both background and text-align in titlestyle, Articles containing unverified chemical infoboxes, Articles with unsourced statements from April 2020, Creative Commons Attribution-ShareAlike License, This page was last edited on 28 June 2020, at 23:33. Mass Spectrometry - Fragmentation Patterns, [ "article:topic", "Fragmentation Patterns (mass spec)", "showtoc:no" ]. A, 1216, 2009, 1630-1639. umn class: Standard non-polar; Column type: Capillary; Start T: 100 C; CAS no: 108930; Active phase: Methyl Silicone; Data type: Normal alkane RI; Authors: Lebron-Aguilar, R.; Quintanilla-Lopez, J.E. and their effect on Phytophthora cinnamomi rands, Aust. ; Flanagan, R.J., Detection and Identification of Volatile Organic Compounds in Blood by Headspace Gas Chromatography as an Aid to the Diagnosis of Solvent Abuse, J. Alpha-cleavage dominates aliphatic amines. ; Jurs, P.C., Quantitative structure-retention and structure-odor intensity relationships for a diverse group of odor-active compounds, Anal. 3), 2003. class: Standard non-polar; Column diameter: 0.53 mm; Column length: 60 m; Column type: Capillary; Description: 40C(6min)=>5C/min=>80C=>10C/min=>200C; CAS no: 108930; Active phase: SPB-1; Carrier gas: He; Phase thickness: 5 um; Data type: Normal alkane RI; Authors: Flanagan, R.J.; Streete, P.J. Copyright for NIST Standard Reference Data is governed by Food Chem., 50, 2002, 549-554. ass: Standard polar; Column diameter: 0.32 mm; Column length: 60 m; Column type: Capillary; Heat rate: 4 K/min; Start T: 40 C; End T: 230 C; End time: 25 min; Start time: 5 min; CAS no: 108930; Active phase: DB-Wax; Carrier gas: H2; Phase thickness: 0.25 um; Data type: Normal alkane RI; Authors: Dregus, M.; Engel, K.-H., Volatile constituents of uncooked Rhubarb (Rheum rhabarbarum L.) stalks, J. Agric. A, 1216, 2009, 1630-1639. umn class: Standard non-polar; Column type: Capillary; Start T: 80 C; CAS no: 108930; Active phase: Methyl Silicone; Data type: Normal alkane RI; Authors: Lebron-Aguilar, R.; Quintanilla-Lopez, J.E. [all data], Go To: Top, Gas phase ion energetics data, References. Chromatogr., 436, 1988, 137-172. ass: Standard non-polar; Column type: Capillary; CAS no: 108930; Active phase: Methyl Silicone; Data type: Linear RI; Authors: Peng, C.T. ; Nogueira, R.I.; Pontes, S.M. Org. Chem., 62, 1990, 2676-2684. ass: Standard non-polar; Column type: Capillary; CAS no: 108930; Active phase: OV-101; Data type: Normal alkane RI; Authors: Krings, U.; Banavara, D.S. Molecular ion peak is an odd number. ; Flanagan, R.J., Detection and Identification of Volatile Organic Compounds in Blood by Headspace Gas Chromatography as an Aid to the Diagnosis of Solvent Abuse, J.
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