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6-Methyl-3,3-bisphenylthioheptan-4-ol

View entire compound with spectra: 1 MS (GC)

6-Methyl-3,3-bisphenylthioheptan-4-ol
SpectraBase Compound ID LTa0MsvW7pe
InChI InChI=1S/C20H26OS2/c1-4-20(19(21)15-16(2)3,22-17-11-7-5-8-12-17)23-18-13-9-6-10-14-18/h5-14,16,19,21H,4,15H2,1-3H3
InChIKey AXNGJUIJUITEQL-UHFFFAOYSA-N
Mol Weight 346.55 g/mol
Molecular Formula C20H26OS2
Exact Mass 346.142508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PcdznIKV7f
Name 6-Methyl-3,3-bisphenylthioheptan-4-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26OS2
InChI InChI=1S/C20H26OS2/c1-4-20(19(21)15-16(2)3,22-17-11-7-5-8-12-17)23-18-13-9-6-10-14-18/h5-14,16,19,21H,4,15H2,1-3H3
InChIKey AXNGJUIJUITEQL-UHFFFAOYSA-N
Molecular Weight 346.547 g/mol
SMILES OC(C(Sc1ccccc1)(Sc1ccccc1)CC)CC(C)C
SPLASH splash10-01p9-0980000000-a3b7e55778d46c6fbe8f
Source of Spectrum KC-1985-1240-19
Synonyms 2-Methyl-5,5-bis(phenylsulfanyl)-4-heptanol 2-Methyl-5,5-bis(phenylthio)-4-heptanol 2-Methyl-5,5-bis(phenylsulfanyl)heptan-4-ol
Wiley ID 1339335