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2-Nitrobenzaldehyde
SpectraBase Compound ID 3YR0v9TBZNd
InChI InChI=1S/C7H5NO3/c9-5-6-3-1-2-4-7(6)8(10)11/h1-5H
InChIKey CMWKITSNTDAEDT-UHFFFAOYSA-N
Mol Weight 151.12 g/mol
Molecular Formula C7H5NO3
Exact Mass 151.026943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5WF1uASnYSu
Name o-Nitrobenzaldehyde
CAS Registry Number 552-89-6
Classification Designer 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 151.026943022 u
Formula C7H5NO3
InChI InChI=1S/C7H5NO3/c9-5-6-3-1-2-4-7(6)8(10)11/h1-5H
InChIKey CMWKITSNTDAEDT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 151.121 g/mol
Nominal Mass 151 u
Quality 998
Retention Index 1281
SMILES C1(=C(C=CC=C1)C=O)[N+](=O)[O-]
SPLASH splash10-0g6r-9300000000-9ae99d3d13b372f2a065
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-Nitrobenzaldehyde
Technique GC/MS
Wiley ID DD2024_024312