SpectraBase Spectrum ID |
5YNowKqPUP2 |
Name |
N-Butyl-3-methylbenzylamine |
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 |
177.151749616 u |
Formula |
C12H19N |
InChI |
InChI=1S/C12H19N/c1-3-4-8-13-10-12-7-5-6-11(2)9-12/h5-7,9,13H,3-4,8,10H2,1-2H3 |
InChIKey |
WCFIZXRUMMCIQK-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
177.291 g/mol |
Nominal Mass |
177 u |
Quality |
953 |
Retention Index |
1404 |
SMILES |
C=1(C=C(C=CC1)C)CNCCCC |
SPLASH |
splash10-0a59-4900000000-851f5375954f1f52dc0d |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-(3-Methylbenzyl)-1-butanamine
N-3-Methylbenzylbutanamine
N-Butyl-3-methylbenzenemethanamine
N-(3-Methylbenzyl)butan-1-amine |
Technique |
GC/MS |
Wiley ID |
DD2024_019968 |