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4-Amino-3,5-dinitrobenzoic acid
SpectraBase Compound ID LLpPchD36XX
InChI InChI=1S/C7H5N3O6/c8-6-4(9(13)14)1-3(7(11)12)2-5(6)10(15)16/h1-2H,8H2,(H,11,12)
InChIKey RMVUGEPUWQMQPR-UHFFFAOYSA-N
Mol Weight 227.13 g/mol
Molecular Formula C7H5N3O6
Exact Mass 227.017835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8wxn7rKYEF2
Name 4-Amino-3,5-dinitrobenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5N3O6
InChI InChI=1S/C7H5N3O6/c8-6-4(9(13)14)1-3(7(11)12)2-5(6)10(15)16/h1-2H,8H2,(H,11,12)
InChIKey RMVUGEPUWQMQPR-UHFFFAOYSA-N
Molecular Weight 227.132 g/mol
SMILES Nc1c(cc(C(=O)O)cc1N(=O)=O)N(=O)=O
SPLASH splash10-0gyc-9210000000-0a78a00335a0132c4b4f
Source of Spectrum IY-2-5131-6
Synonyms Benzoic acid, 4-amino-3,5-dinitro-
Wiley ID 1659299