SpectraBase Spectrum ID |
8K8SR6d0qa8 |
Name |
N-(3-Methylphenyl)pentanamide |
Classification |
Chemical |
Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
191.131014170 u |
Formula |
C12H17NO |
InChI |
InChI=1S/C12H17NO/c1-3-4-8-12(14)13-11-7-5-6-10(2)9-11/h5-7,9H,3-4,8H2,1-2H3,(H,13,14) |
InChIKey |
RTVXANSLXIIIKG-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
191.274 g/mol |
Nominal Mass |
191 u |
Quality |
987 |
Retention Index |
1733 |
SMILES |
C=1(NC(CCCC)=O)C=C(C=CC1)C |
SPLASH |
splash10-0a4i-2900000000-a5dfd7f04da504d04019 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Pentanamide,N-(3-methylphenyl)- |
Technique |
GC/MS |
Wiley ID |
DD2024_028182 |