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(2'E)-4,4a,5,6,7,8-hexahydro-4a-methyl-2-[3'-(phenylsulfinyl)prop-2-enyl]-2(3H)-naphthalenol
SpectraBase Compound ID Il5O98JEc88
InChI InChI=1S/C20H26O2S/c1-19-11-6-5-8-17(19)16-20(21,14-13-19)12-7-15-23(22)18-9-3-2-4-10-18/h2-4,7,9-10,15-16,21H,5-6,8,11-14H2,1H3/b15-7+
InChIKey WEMVYFANWJYKGS-VIZOYTHASA-N
Mol Weight 330.49 g/mol
Molecular Formula C20H26O2S
Exact Mass 330.165351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YI6MRl2ZFz
Name (2'E)-4,4a,5,6,7,8-hexahydro-4a-methyl-2-[3'-(phenylsulfinyl)prop-2-enyl]-2(3H)-naphthalenol
Alternate Name(s) 4a-methyl-2-[(2E)-3-(phenylsulfinyl)-2-propenyl]-2,3,4,4a,5,6,7,8-octahydro-2-naphthalenol
CAS Registry Number 114678-83-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O2S
InChI InChI=1S/C20H26O2S/c1-19-11-6-5-8-17(19)16-20(21,14-13-19)12-7-15-23(22)18-9-3-2-4-10-18/h2-4,7,9-10,15-16,21H,5-6,8,11-14H2,1H3/b15-7+
InChIKey WEMVYFANWJYKGS-VIZOYTHASA-N
Molecular Weight 330.486 g/mol
SMILES OC1(C=C2C(CC1)(C)CCCC2)C\C=C\S(=O)c1ccccc1
SPLASH splash10-00kb-0911000000-25b3a7379588046bae82
Source of Spectrum C-110-5421-52
Wiley ID 1328028