| SpectraBase Spectrum ID |
JHuEKsymIwi |
| Name |
N-Butyl-3-chlorophenethylamine |
| Classification |
Potentially neurotoxic |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
211.112777284 u |
| Formula |
C12H18ClN |
| InChI |
InChI=1S/C12H18ClN/c1-2-3-8-14-9-7-11-5-4-6-12(13)10-11/h4-6,10,14H,2-3,7-9H2,1H3 |
| InChIKey |
XNZSCGMKWUKXBK-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
211.736 g/mol |
| Nominal Mass |
211 u |
| Quality |
979 |
| Retention Index |
1585 |
| SMILES |
C=1(C=C(C=CC1)Cl)CCNCCCC |
| SPLASH |
splash10-000l-9100000000-ba1c1b6705297d452c1e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Phenethylamine,N-butyl-3-chloro
N-(2-(3-chlorophenyl)ethyl)butan-1-amine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002553 |
