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1-[3-(p-tolylsulfonylmethyl)-2-furyl]-2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethanol
SpectraBase Compound ID KldoyVRZJbr
InChI InChI=1S/C23H30O4S/c1-16-7-9-19(10-8-16)28(25,26)15-18-11-13-27-22(18)21(24)14-20-17(2)6-5-12-23(20,3)4/h6-11,13,20-21,24H,5,12,14-15H2,1-4H3
InChIKey HHYYNKIYNQXNST-UHFFFAOYSA-N
Mol Weight 402.55 g/mol
Molecular Formula C23H30O4S
Exact Mass 402.186481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZFPvpIsA92
Name 1-[3-(p-tolylsulfonylmethyl)-2-furyl]-2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O4S
InChI InChI=1S/C23H30O4S/c1-16-7-9-19(10-8-16)28(25,26)15-18-11-13-27-22(18)21(24)14-20-17(2)6-5-12-23(20,3)4/h6-11,13,20-21,24H,5,12,14-15H2,1-4H3
InChIKey HHYYNKIYNQXNST-UHFFFAOYSA-N
Molecular Weight 402.549 g/mol
SMILES OC(CC1C(=CCCC1(C)C)C)c1c(CS(c2ccc(cc2)C)(=O)=O)cco1
SPLASH splash10-03e9-9000000000-bd35035e8e5683fb9c02
Source of Spectrum J-60-3583-5
Synonyms 1-[3-(tosylmethyl)-2-furyl]-2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethanol 1-[3-[(4-methylphenyl)sulfonylmethyl]-2-furanyl]-2-(2,6,6-trimethyl-1-cyclohex-2-enyl)ethanol 1-[3-[(4-methylphenyl)sulfonylmethyl]furan-2-yl]-2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethanol
Wiley ID 1370408