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Hexanamide, 4-hydroxy-N-methyl-2-[(phenylthio)methylene]-, (E)-
SpectraBase Compound ID 1shdfhkto12
InChI InChI=1S/C14H19NO2S/c1-3-12(16)9-11(14(17)15-2)10-18-13-7-5-4-6-8-13/h4-8,10,12,16H,3,9H2,1-2H3,(H,15,17)/b11-10+
InChIKey ZLCOPYJOGSJQOI-ZHACJKMWSA-N
Mol Weight 265.37 g/mol
Molecular Formula C14H19NO2S
Exact Mass 265.11365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J8UwuvFHzTJ
Name Hexanamide, 4-hydroxy-N-methyl-2-[(phenylthio)methylene]-, (E)-
CAS Registry Number 105970-85-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NO2S
InChI InChI=1S/C14H19NO2S/c1-3-12(16)9-11(14(17)15-2)10-18-13-7-5-4-6-8-13/h4-8,10,12,16H,3,9H2,1-2H3,(H,15,17)/b11-10+
InChIKey ZLCOPYJOGSJQOI-ZHACJKMWSA-N
Molecular Weight 265.371 g/mol
SMILES N(C(\C(CC(O)CC)=C/Sc1ccccc1)=O)C
SPLASH splash10-0a4j-4890000000-b7c5d5459a02c83fcb25
Source of Spectrum J-52-224-24
Synonyms (2E)-2-(2-hydroxybutyl)-N-methyl-3-(phenylsulfanyl)-2-propenamide (E)-1-(phenylthio)-N-methyl-4-hydroxy-1-hexene-2-carboxamide
Wiley ID 1268904