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1-[1-chloro-1-(phenylsulfinyl)heptyl]-2-cyclohexen-1-ol

View entire compound with spectra: 1 MS (GC)

1-[1-chloro-1-(phenylsulfinyl)heptyl]-2-cyclohexen-1-ol
SpectraBase Compound ID 8me6ZBuEb88
InChI InChI=1S/C19H27ClO2S/c1-2-3-4-11-16-19(20,18(21)14-9-6-10-15-18)23(22)17-12-7-5-8-13-17/h5,7-9,12-14,21H,2-4,6,10-11,15-16H2,1H3
InChIKey IUZABOMAGSOWGU-UHFFFAOYSA-N
Mol Weight 354.94 g/mol
Molecular Formula C19H27ClO2S
Exact Mass 354.142029 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J21k5DwtM5G
Name 1-[1-chloro-1-(phenylsulfinyl)heptyl]-2-cyclohexen-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27ClO2S
InChI InChI=1S/C19H27ClO2S/c1-2-3-4-11-16-19(20,18(21)14-9-6-10-15-18)23(22)17-12-7-5-8-13-17/h5,7-9,12-14,21H,2-4,6,10-11,15-16H2,1H3
InChIKey IUZABOMAGSOWGU-UHFFFAOYSA-N
Molecular Weight 354.936 g/mol
SMILES OC1(C(S(=O)c2ccccc2)(Cl)CCCCCC)C=CCCC1
SPLASH splash10-002b-9820000000-2c8cbd74c8e335281f78
Source of Spectrum AJ-65-2970-3
Wiley ID 771787