SpectraBase Spectrum ID |
2pM6KQ8Mmye |
Name |
N-Butyl-1-phenethylamine |
CAS Registry Number |
5412-64-6 |
Classification |
Phenethylamine analog |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
177.151749616 u |
Formula |
C12H19N |
InChI |
InChI=1S/C12H19N/c1-3-4-10-13-11(2)12-8-6-5-7-9-12/h5-9,11,13H,3-4,10H2,1-2H3 |
InChIKey |
SHHMVRIBSOJMCK-UHFFFAOYSA-N |
Ionization Type |
Chemical Ionization (CI) |
Molecular Weight |
177.291 g/mol |
Nominal Mass |
177 u |
Reagent Gas |
Methanol |
Retention Index |
1395 |
SMILES |
C1(C(NCCCC)C)=CC=CC=C1 |
SPLASH |
splash10-004i-8900000000-1e4240249d6955b86201 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-Butyl-alpha-methylbenzylamine
N-(1-Phenylethyl)butan-1-amine |
Technique |
GC/MS |
Wiley ID |
DD2024_010070 |