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2-(2-hydroxy-3-methyl-butyl)-N-methyl-benzenecarbothioamide
SpectraBase Compound ID AeWSQWL8Och
InChI InChI=1S/C13H19NOS/c1-9(2)12(15)8-10-6-4-5-7-11(10)13(16)14-3/h4-7,9,12,15H,8H2,1-3H3,(H,14,16)
InChIKey SCWMMSSNIPNCRM-UHFFFAOYSA-N
Mol Weight 237.36 g/mol
Molecular Formula C13H19NOS
Exact Mass 237.118735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NnUxnlQSTn
Name 2-(2-hydroxy-3-methyl-butyl)-N-methyl-benzenecarbothioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NOS
InChI InChI=1S/C13H19NOS/c1-9(2)12(15)8-10-6-4-5-7-11(10)13(16)14-3/h4-7,9,12,15H,8H2,1-3H3,(H,14,16)
InChIKey SCWMMSSNIPNCRM-UHFFFAOYSA-N
Molecular Weight 237.361 g/mol
SMILES OC(Cc1c(C(=S)NC)cccc1)C(C)C
SPLASH splash10-052f-9220000000-28cb3d5bc53e810b1eff
Source of Spectrum U1-2002-2582-33
Synonyms N-methyl-2-(3-methyl-2-oxidanyl-butyl)benzenecarbothioamide 2-(2-hydroxy-3-methylbutyl)-N-methylbenzenecarbothioamide
Wiley ID 1522908