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3-Cyclohexeneethanol, .beta.,4-dimethyl-, 4-methylbenzenesulfonate
SpectraBase Compound ID GypZDE0ogEr
InChI InChI=1S/C17H24O3S/c1-13-8-10-16(11-9-13)21(18,19)20-12-15(3)17-7-5-4-6-14(17)2/h5,7-11,14-15,17H,4,6,12H2,1-3H3
InChIKey TYDDXIXUOVZNAT-UHFFFAOYSA-N
Mol Weight 308.44 g/mol
Molecular Formula C17H24O3S
Exact Mass 308.144616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Qsmorsm4UC
Name 3-Cyclohexeneethanol, .beta.,4-dimethyl-, 4-methylbenzenesulfonate
CAS Registry Number 54965-15-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3S
InChI InChI=1S/C17H24O3S/c1-13-8-10-16(11-9-13)21(18,19)20-12-15(3)17-7-5-4-6-14(17)2/h5,7-11,14-15,17H,4,6,12H2,1-3H3
InChIKey TYDDXIXUOVZNAT-UHFFFAOYSA-N
Molecular Weight 308.436 g/mol
SMILES Cc1ccc(cc1)S(=O)(=O)OCC(C)C1C=CCCC1C
SPLASH splash10-0006-9400000000-a0fbe122907041416207
Source of Spectrum AD-0-4639-0
Synonyms 2-(6-Methyl-2-cyclohexen-1-yl)propyl 4-methylbenzenesulfonate 2-(6-Methylcyclohex-2-en-1-yl)propyl 4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid 2-(6-methyl-1-cyclohex-2-enyl)propyl ester 4-Methylbenzenesulfonic acid 2-(6-methylcyclohex-2-en-1-yl)propyl ester
Wiley ID 1309753