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1-[3'-methyl-1'-(phenylsulfinyl)but-2'-enyl]cyclohex-2-en-ol
SpectraBase Compound ID GJa3ffTk4o5
InChI InChI=1S/C17H22O2S/c1-14(2)13-16(17(18)11-7-4-8-12-17)20(19)15-9-5-3-6-10-15/h3,5-7,9-11,13,16,18H,4,8,12H2,1-2H3
InChIKey LGPRZTHQDYXKRT-UHFFFAOYSA-N
Mol Weight 290.42 g/mol
Molecular Formula C17H22O2S
Exact Mass 290.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HgKLuaq50c0
Name 1-[3'-methyl-1'-(phenylsulfinyl)but-2'-enyl]cyclohex-2-en-ol
Alternate Name(s) 1-[3-methyl-1-(phenylsulfinyl)-2-butenyl]-2-cyclohexen-1-ol
CAS Registry Number 114718-27-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O2S
InChI InChI=1S/C17H22O2S/c1-14(2)13-16(17(18)11-7-4-8-12-17)20(19)15-9-5-3-6-10-15/h3,5-7,9-11,13,16,18H,4,8,12H2,1-2H3
InChIKey LGPRZTHQDYXKRT-UHFFFAOYSA-N
Molecular Weight 290.421 g/mol
SMILES OC1(C(S(=O)c2ccccc2)C=C(C)C)C=CCCC1
SPLASH splash10-004i-4900000000-cb8ebbdbf345e000bfd2
Source of Spectrum C-110-5420-47
Wiley ID 1293676