SpectraBase Spectrum ID |
2m6xFIE8NGa |
Name |
4-Chlorobenzylamine |
CAS Registry Number |
104-86-9 |
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 |
141.034526962 u |
Formula |
C7H8ClN |
InChI |
InChI=1S/C7H8ClN/c8-7-3-1-6(5-9)2-4-7/h1-4H,5,9H2 |
InChIKey |
YMVFJGSXZNNUDW-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
141.601 g/mol |
Nominal Mass |
141 u |
Quality |
947 |
Retention Index |
1180 |
SMILES |
NCC1=CC=C(C=C1)Cl |
SPLASH |
splash10-0a6u-6900000000-50a0285adcfac14e5f07 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
4-Chloro-benzenemethanamine
1-(4-Chlorophenyl)methanamine |
Technique |
GC/MS |
Wiley ID |
DD2024_022831 |