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iso-Pentyl N-benzoylthiocarbamate
SpectraBase Compound ID 7noM4PL33CL
InChI InChI=1S/C13H17NO2S/c1-10(2)8-9-16-13(17)14-12(15)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,14,15,17)
InChIKey QHNMJAVVPKZHJH-UHFFFAOYSA-N
Mol Weight 251.34 g/mol
Molecular Formula C13H17NO2S
Exact Mass 251.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3KPzyj1nuTA
Name iso-Pentyl N-benzoylthiocarbamate
Alternate Name(s) O-isopentyl benzoylthiocarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO2S
InChI InChI=1S/C13H17NO2S/c1-10(2)8-9-16-13(17)14-12(15)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,14,15,17)
InChIKey QHNMJAVVPKZHJH-UHFFFAOYSA-N
Molecular Weight 251.344 g/mol
SMILES N(C(=O)c1ccccc1)C(=S)OCCC(C)C
SPLASH splash10-0a6r-5900000000-3e3a161591ff5c15fde2
Source of Spectrum KC-61-5815-3
Wiley ID 1629593