| SpectraBase Spectrum ID |
IUvlicHNw |
| Name |
3-Nitrobenzaldehyde |
| 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 |
151.026943022 u |
| Formula |
C7H5NO3 |
| InChI |
InChI=1S/C7H5NO3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-5H |
| InChIKey |
ZETIVVHRRQLWFW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
151.121 g/mol |
| Nominal Mass |
151 u |
| Quality |
998 |
| Retention Index |
1300 |
| SMILES |
C1(=CC([N+](=O)[O-])=CC=C1)C=O |
| SPLASH |
splash10-0udi-9600000000-3786c543ea06ec6cf9c8 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Benzaldehyde,4-nitro- |
| Technique |
GC/MS |
| Wiley ID |
DD2024_026542 |
