| SpectraBase Spectrum ID |
2mDNTsrJ9Cy |
| Name |
Aniline |
| CAS Registry Number |
14545-23-4 |
| Classification |
Precursor to many industrial chemicals |
| 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 |
93.057849229 u |
| Formula |
C6H7N |
| InChI |
InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2 |
| InChIKey |
PAYRUJLWNCNPSJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
93.129 g/mol |
| Nominal Mass |
93 u |
| Quality |
969 |
| Retention Index |
756 |
| SMILES |
NC1=CC=CC=C1 |
| SPLASH |
splash10-00kf-9000000000-e8881ea057d8610fefd0 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Benzenamine
Phenylamine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_011603 |
