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(1R)-1-[(Ethoxycarbonyl)methyl]-2-(p-tolylthio)cyclohex-2-en-1-ol
SpectraBase Compound ID DNg6xgiT0bQ
InChI InChI=1S/C17H22O3S/c1-3-20-16(18)12-17(19)11-5-4-6-15(17)21-14-9-7-13(2)8-10-14/h6-10,19H,3-5,11-12H2,1-2H3/t17-/m1/s1
InChIKey BULFYUYFARSAOC-QGZVFWFLSA-N
Mol Weight 306.42 g/mol
Molecular Formula C17H22O3S
Exact Mass 306.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BX9VAWCfqQq
Name (1R)-1-[(Ethoxycarbonyl)methyl]-2-(p-tolylthio)cyclohex-2-en-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O3S
InChI InChI=1S/C17H22O3S/c1-3-20-16(18)12-17(19)11-5-4-6-15(17)21-14-9-7-13(2)8-10-14/h6-10,19H,3-5,11-12H2,1-2H3/t17-/m1/s1
InChIKey BULFYUYFARSAOC-QGZVFWFLSA-N
Molecular Weight 306.420 g/mol
SMILES O[C@@]1(C(Sc2ccc(cc2)C)=CCCC1)CC(=O)OCC
SPLASH splash10-00di-0942000000-b1a468d4b05e1db9dddc
Source of Spectrum QC-9-3451-12
Synonyms Ethyl {(1R)-1-hydroxy-2-[(4-methylphenyl)sulfanyl]-2-cyclohexen-1-yl}acetate
Wiley ID 870768