SpectraBase Spectrum ID |
5XSXlusih8a |
Name |
N-Methylbenzylamine |
CAS Registry Number |
103-67-3 |
Classification |
Pharmaceutical drug precursor |
Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
121.089149358 u |
Formula |
C8H11N |
InChI |
InChI=1S/C8H11N/c1-9-7-8-5-3-2-4-6-8/h2-6,9H,7H2,1H3 |
InChIKey |
RIWRFSMVIUAEBX-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
121.183 g/mol |
Nominal Mass |
121 u |
Quality |
989 |
Retention Index |
1070 |
SMILES |
C1(CNC)=CC=CC=C1 |
SPLASH |
splash10-006x-9400000000-58cbe132ca24ddce3b00 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-Methylbenzenemethanamine
N-Methyl-1-phenyl-methanamine |
Technique |
GC/MS |
Wiley ID |
DD2024_030076 |