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2-(2-hydroxy-3-methyl-butyl)-N-phenyl-benzenecarbothioamide
SpectraBase Compound ID MsYhq2Yvka
InChI InChI=1S/C18H21NOS/c1-13(2)17(20)12-14-8-6-7-11-16(14)18(21)19-15-9-4-3-5-10-15/h3-11,13,17,20H,12H2,1-2H3,(H,19,21)
InChIKey JGMSGPKQLDFPTJ-UHFFFAOYSA-N
Mol Weight 299.43 g/mol
Molecular Formula C18H21NOS
Exact Mass 299.134385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32rTEEtOZYa
Name 2-(2-hydroxy-3-methyl-butyl)-N-phenyl-benzenecarbothioamide
Alternate Name(s) 2-(3-Methyl-2-oxidanyl-butyl)-N-phenyl-benzenecarbothioamide 2-(2-hydroxy-3-methylbutyl)-N-phenylbenzenecarbothioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NOS
InChI InChI=1S/C18H21NOS/c1-13(2)17(20)12-14-8-6-7-11-16(14)18(21)19-15-9-4-3-5-10-15/h3-11,13,17,20H,12H2,1-2H3,(H,19,21)
InChIKey JGMSGPKQLDFPTJ-UHFFFAOYSA-N
Molecular Weight 299.432 g/mol
SMILES OC(Cc1c(C(Nc2ccccc2)=S)cccc1)C(C)C
SPLASH splash10-01dm-7290000000-cec67460bc7aa7806bca
Source of Spectrum U1-2002-2583-41
Wiley ID 1522900