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2-nitroisophthalic acid
SpectraBase Compound ID 1OeUzENkUu4
InChI InChI=1S/C8H5NO6/c10-7(11)4-2-1-3-5(8(12)13)6(4)9(14)15/h1-3H,(H,10,11)(H,12,13)
InChIKey CAHWDGJDQYAFHM-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 2zY2PlmqKmP
Name
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Formula C8H5NO6
InChI InChI=1S/C8H5NO6/c10-7(11)4-2-1-3-5(8(12)13)6(4)9(14)15/h1-3H,(H,10,11)(H,12,13)
InChIKey CAHWDGJDQYAFHM-UHFFFAOYSA-N
Molecular Weight 211.0115
SMILES OC(c1cccc(C(O)=O)c1N(=O)=O)=O
SPLASH splash10-00l5-9400000000-a20658c6468597ee84e5
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