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3-Nitrocinnoline-4-carboxaldehyde oxime
SpectraBase Compound ID K5JdTHyNo4m
InChI InChI=1S/C9H6N4O3/c14-10-5-7-6-3-1-2-4-8(6)11-12-9(7)13(15)16/h1-5,14H/b10-5+
InChIKey QGVZHQBMFCNVJR-BJMVGYQFSA-N
Mol Weight 218.17 g/mol
Molecular Formula C9H6N4O3
Exact Mass 218.04399 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID mrodG1TUu8
Name 3-Nitrocinnoline-4-carboxaldehyde oxime
CAS Registry Number 87953-98-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6N4O3
InChI InChI=1S/C9H6N4O3/c14-10-5-7-6-3-1-2-4-8(6)11-12-9(7)13(15)16/h1-5,14H/b10-5+
InChIKey QGVZHQBMFCNVJR-BJMVGYQFSA-N
Molecular Weight 218.172 g/mol
SMILES O\N=C\c1c(N(=O)=O)nnc2ccccc12
SPLASH splash10-01b9-0910000000-1e1dc657734e196a689c
Source of Spectrum J-49-293-0
Synonyms 3-Nitro-4-cinnolinecarbaldehyde oxime
Wiley ID 1217036