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5-Nitroisophthalic acid
SpectraBase Compound ID 10Rkw3lKqns
InChI InChI=1S/C8H5NO6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)(H,12,13)
InChIKey NBDAHKQJXVLAID-UHFFFAOYSA-N
Mol Weight 211.13 g/mol
Molecular Formula C8H5NO6
Exact Mass 211.011687 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4w8jbu6pQ9d
Name 1,3-Benzenedicarboxylic acid, 5-nitro-
CAS Registry Number 618-88-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5NO6
InChI InChI=1S/C8H5NO6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)(H,12,13)
InChIKey NBDAHKQJXVLAID-UHFFFAOYSA-N
Molecular Weight 211.129 g/mol
SMILES OC(c1cc(C(=O)O)cc(c1)N(=O)=O)=O
SPLASH splash10-02t9-9740000000-1e1dd79d14fe7febf18d
Source of Spectrum W5-0-0-0
Synonyms 1-Nitrobenzene-3,5-dicarboxylic acid 5-Nitro-1,3-benzenedicarboxylic acid 5-Nitroisophthalic acid 5-Nitro-m-phthalic acid 5-Nitrobenzene-1,3-dicarboxylic acid Isophthalic acid, 5-nitro- EINECS 210-568-3 NSC 66545
Wiley ID 1210130