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6-Mercapto-2,2-dimethyl-4-phenyl-3-hexanol
SpectraBase Compound ID 296hvLIQR8l
InChI InChI=1S/C14H22OS/c1-14(2,3)13(15)12(9-10-16)11-7-5-4-6-8-11/h4-8,12-13,15-16H,9-10H2,1-3H3
InChIKey YYDPHZVJPVWXQN-UHFFFAOYSA-N
Mol Weight 238.39 g/mol
Molecular Formula C14H22OS
Exact Mass 238.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dn7eKKMkQyq
Name 6-Mercapto-2,2-dimethyl-4-phenyl-3-hexanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22OS
InChI InChI=1S/C14H22OS/c1-14(2,3)13(15)12(9-10-16)11-7-5-4-6-8-11/h4-8,12-13,15-16H,9-10H2,1-3H3
InChIKey YYDPHZVJPVWXQN-UHFFFAOYSA-N
Molecular Weight 238.389 g/mol
SMILES SCCC(C(C(C)(C)C)O)c1ccccc1
SPLASH splash10-014l-9600000000-9ebeeefe965400a14d15
Source of Spectrum F-53-5567-3
Synonyms 6-Mercapto-2,2-dimethyl-4-phenyl-3-hexanol isomer 2,2-Dimethyl-4-phenyl-6-sulfanyl-3-hexanol
Wiley ID 801661