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(E)-S-(3-(p-tolyl)allyl) butylcarbamothioate
SpectraBase Compound ID 7h03G9gAA44
InChI InChI=1S/C15H21NOS/c1-3-4-11-16-15(17)18-12-5-6-14-9-7-13(2)8-10-14/h5-10H,3-4,11-12H2,1-2H3,(H,16,17)/b6-5+
InChIKey YFGAQRYUXNCKEM-AATRIKPKSA-N
Mol Weight 263.4 g/mol
Molecular Formula C15H21NOS
Exact Mass 263.134385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZjAhOLt5LR
Name (E)-S-(3-(p-tolyl)allyl) butylcarbamothioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21NOS
InChI InChI=1S/C15H21NOS/c1-3-4-11-16-15(17)18-12-5-6-14-9-7-13(2)8-10-14/h5-10H,3-4,11-12H2,1-2H3,(H,16,17)/b6-5+
InChIKey YFGAQRYUXNCKEM-AATRIKPKSA-N
Literature Reference DOI 10.1021/jo1006152
Molecular Weight 263.399 g/mol
SMILES N(C(SC\C=C\c1ccc(cc1)C)=O)CCCC
SPLASH splash10-001i-2910000000-60a9acf1854aca6ed0de
Source of Spectrum J-75-4615/SMS12-3d
Synonyms N-butylcarbamothioic acid S-[(E)-3-(4-methylphenyl)prop-2-enyl] ester S-[(E)-3-(p-tolyl)allyl] N-butylcarbamothioate S-[(E)-3-(4-methylphenyl)prop-2-enyl] N-butylcarbamothioate
Wiley ID 1751675