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3-Pentanol, 2,2,4-trimethyl-4-(phenylthio)-
SpectraBase Compound ID 3PdRLQTl227
InChI InChI=1S/C14H22OS/c1-13(2,3)12(15)14(4,5)16-11-9-7-6-8-10-11/h6-10,12,15H,1-5H3
InChIKey LNFKQDSMNMWASC-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 181OfB2ucgV
Name 3-Pentanol, 2,2,4-trimethyl-4-(phenylthio)-
CAS Registry Number 66164-73-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22OS
InChI InChI=1S/C14H22OS/c1-13(2,3)12(15)14(4,5)16-11-9-7-6-8-10-11/h6-10,12,15H,1-5H3
InChIKey LNFKQDSMNMWASC-UHFFFAOYSA-N
Molecular Weight 238.389 g/mol
SMILES OC(C(Sc1ccccc1)(C)C)C(C)(C)C
SPLASH splash10-114i-0900000000-0d5b738147949a4aab7d
Source of Spectrum KC-1977-20-2279
Synonyms 2,2,4-trimethyl-4-(phenylsulfanyl)-3-pentanol 2,4,4-Trimethyl-2-phenylthiopentan-3-ol
Wiley ID 1240718