| SpectraBase Spectrum ID |
JJEE1bsLyqW |
| Name |
(3-Methylphenyl)methanamine 2BUT |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
261.172878983 u |
| Formula |
C16H23NO2 |
| InChI |
InChI=1S/C16H23NO2/c1-4-7-15(18)17(16(19)8-5-2)12-14-10-6-9-13(3)11-14/h6,9-11H,4-5,7-8,12H2,1-3H3 |
| InChIKey |
SHQUKEDRHWDNGN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
261.365 g/mol |
| Nominal Mass |
261 u |
| Quality |
991 |
| Retention Index |
1893 |
| SMILES |
C(N(C(CCC)=O)CC1=CC(=CC=C1)C)(CCC)=O |
| SPLASH |
splash10-00dl-4900000000-4e71a732f270c602ec14 |
| Sample Comments |
Butanoyl position uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N,N-Dibutyryl-(3-methylphenyl)methanamine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004555 |
