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2-Chloranyl-4,6-dinitro-benzoic acid
SpectraBase Compound ID 130cqI7wZe5
InChI InChI=1S/C7H3ClN2O6/c8-4-1-3(9(13)14)2-5(10(15)16)6(4)7(11)12/h1-2H,(H,11,12)
InChIKey QBIQLTOUDBEJCV-UHFFFAOYSA-N
Mol Weight 246.56 g/mol
Molecular Formula C7H3ClN2O6
Exact Mass 245.967964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rDICNNCpMe
Name 2-Chloranyl-4,6-dinitro-benzoic acid
Alternate Name(s) 2-Chloro-4,6-dinitro-benzoic acid
CAS Registry Number 95192-61-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3ClN2O6
InChI InChI=1S/C7H3ClN2O6/c8-4-1-3(9(13)14)2-5(10(15)16)6(4)7(11)12/h1-2H,(H,11,12)
InChIKey QBIQLTOUDBEJCV-UHFFFAOYSA-N
Molecular Weight 246.562 g/mol
SMILES OC(c1c(N(=O)=O)cc(N(=O)=O)cc1Cl)=O
SPLASH splash10-00dj-9070000000-a33c12e5dd863f84f239
Source of Spectrum J-50-1044-0
Wiley ID 1248306