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2-nitro-m-anisaldehyde

View entire compound with spectra: 4 NMR, 4 FTIR, 1 Raman, and 2 MS (GC)

2-nitro-m-anisaldehyde
SpectraBase Compound ID 5hiclJ3sdHy
InChI InChI=1S/C8H7NO4/c1-13-7-4-2-3-6(5-10)8(7)9(11)12/h2-5H,1H3
InChIKey GDTUACILWWLIJF-UHFFFAOYSA-N
Mol Weight 181.15 g/mol
Molecular Formula C8H7NO4
Exact Mass 181.037508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SggPmkBt5F
Name 3-Methoxy-2-nitrobenzaldehyde
Alternate Name(s) 2-Nitro-3-methoxy benzaldehyde Benzaldehyde, 3-methoxy-2-nitro-
CAS Registry Number 53055-05-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NO4
InChI InChI=1S/C8H7NO4/c1-13-7-4-2-3-6(5-10)8(7)9(11)12/h2-5H,1H3
InChIKey GDTUACILWWLIJF-UHFFFAOYSA-N
Molecular Weight 181.147 g/mol
SMILES COc1c(c(ccc1)C=O)N(=O)=O
SPLASH splash10-016r-9500000000-0c33c13fd702c91278b5
Wiley ID 1491820