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N-Butyl-3-methylbenzamide
SpectraBase Compound ID 7C7HYJHIqMh
InChI InChI=1S/C12H17NO/c1-3-4-8-13-12(14)11-7-5-6-10(2)9-11/h5-7,9H,3-4,8H2,1-2H3,(H,13,14)
InChIKey NXDWJMPJVGIQBB-UHFFFAOYSA-N
Mol Weight 191.27 g/mol
Molecular Formula C12H17NO
Exact Mass 191.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2l32JN7nXqS
Name N-Butyl-3-methylbenzamide
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 191.131014170 u
Formula C12H17NO
InChI InChI=1S/C12H17NO/c1-3-4-8-13-12(14)11-7-5-6-10(2)9-11/h5-7,9H,3-4,8H2,1-2H3,(H,13,14)
InChIKey NXDWJMPJVGIQBB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 191.274 g/mol
Nominal Mass 191 u
Quality 986
Retention Index 1727
SMILES C1(C(NCCCC)=O)=CC(=CC=C1)C
SPLASH splash10-014l-3900000000-53f5b742de3d514eb5df
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Benzamide,N-butyl-3-methyl
Technique GC/MS
Wiley ID DD2024_004667