| SpectraBase Spectrum ID |
JrU5eOv9Re7 |
| Name |
3-Methylbenzylamine BUT |
| Classification |
Chemical |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
191.131014170 u |
| Formula |
C12H17NO |
| InChI |
InChI=1S/C12H17NO/c1-3-5-12(14)13-9-11-7-4-6-10(2)8-11/h4,6-8H,3,5,9H2,1-2H3,(H,13,14) |
| InChIKey |
MSECUELKSSJVBH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
191.274 g/mol |
| Nominal Mass |
191 u |
| Quality |
992 |
| Retention Index |
1754 |
| SMILES |
C(NC(CCC)=O)C1=CC(=CC=C1)C |
| SPLASH |
splash10-052f-5900000000-d72d23efae53808e9c22 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(3-Methylbenzyl)butyramide
N-Butyryl-(3-methylphenyl)methanamine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_019349 |
