| SpectraBase Spectrum ID |
5Zncqs8rTIO |
| Name |
2-Methylaniline |
| CAS Registry Number |
95-53-4 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
107.073499294 u |
| Formula |
C7H9N |
| InChI |
InChI=1S/C7H9N/c1-6-4-2-3-5-7(6)8/h2-5H,8H2,1H3 |
| InChIKey |
RNVCVTLRINQCPJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
107.156 g/mol |
| Nominal Mass |
107 u |
| Quality |
979 |
| Retention Index |
856 |
| SMILES |
C=1(C(=CC=CC1)C)N |
| SPLASH |
splash10-0a4i-5900000000-ac948cfc88581a61073c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_028072 |
