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2-Methyl-7-phenyl-3,5,5-tris(phenylthio)heptan-2-ol
SpectraBase Compound ID LKfqoZMTPI3
InChI InChI=1S/C32H34OS3/c1-25(30(31(2,3)33)34-27-18-10-5-11-19-27)32(24-26-16-8-4-9-17-26,35-28-20-12-6-13-21-28)36-29-22-14-7-15-23-29/h4-23,25,30,33H,24H2,1-3H3/t25-,30-/m0/s1
InChIKey QQIROIDVOULPAA-QCDSWUKFSA-N
Mol Weight 530.8 g/mol
Molecular Formula C32H34OS3
Exact Mass 530.177179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B091vwkNtlQ
Name 2-Methyl-7-phenyl-3,5,5-tris(phenylthio)heptan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H34OS3
InChI InChI=1S/C32H34OS3/c1-25(30(31(2,3)33)34-27-18-10-5-11-19-27)32(24-26-16-8-4-9-17-26,35-28-20-12-6-13-21-28)36-29-22-14-7-15-23-29/h4-23,25,30,33H,24H2,1-3H3/t25-,30-/m0/s1
InChIKey QQIROIDVOULPAA-QCDSWUKFSA-N
Molecular Weight 530.803 g/mol
SMILES OC([C@]([C@@](C(Sc1ccccc1)(Sc1ccccc1)Cc1ccccc1)(C)[H])(Sc1ccccc1)[H])(C)C
SPLASH splash10-03dl-4914000000-ad851e86493066485da4
Source of Spectrum KC-0-2959-16
Synonyms (3S,4S)-2,4-Dimethyl-6-phenyl-3,5,5-tris-phenylsulfanyl-hexan-2-ol 2-Methyl-7-phenyl-3,5,5-tris(phenylsulfanyl)-2-heptanol 2-Methyl-7-phenyl-3,5,5-tris(phenylsulfanyl)heptan-2-ol 2-Methyl-7-phenyl-3,5,5-tris(phenylthio)-2-heptanol
Wiley ID 782391