SpectraBase Spectrum ID |
GeiFKJWlQsc |
Name |
4-Nitrobenzaldehyde |
CAS Registry Number |
555-16-8 |
Classification |
Designer drug precursor |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
151.026943022 u |
Formula |
C7H5NO3 |
InChI |
InChI=1S/C7H5NO3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-5H |
InChIKey |
BXRFQSNOROATLV-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
151.121 g/mol |
Nominal Mass |
151 u |
Quality |
991 |
Retention Index |
1291 |
SMILES |
C=1(C=O)C=CC([N+](=O)[O-])=CC1 |
SPLASH |
splash10-0udi-9800000000-244b3c3440861671cd6e |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Technique |
GC/MS |
Wiley ID |
DD2024_024313 |