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4-Methyl-3-nitrosalicylic acid
SpectraBase Compound ID K7TeQEGviRi
InChI InChI=1S/C8H7NO5/c1-4-2-3-5(8(11)12)7(10)6(4)9(13)14/h2-3,10H,1H3,(H,11,12)
InChIKey RMTKDRALWKWPRC-UHFFFAOYSA-N
Mol Weight 197.15 g/mol
Molecular Formula C8H7NO5
Exact Mass 197.032422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9y0w05pEX6r
Name 4-Methyl-3-nitrosalicylic acid
Alternate Name(s) 2-Hydroxy-4-methyl-3-nitro-benzoic acid 4-Methyl-3-nitro-2-oxidanyl-benzoic acid
CAS Registry Number 24279-12-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NO5
InChI InChI=1S/C8H7NO5/c1-4-2-3-5(8(11)12)7(10)6(4)9(13)14/h2-3,10H,1H3,(H,11,12)
InChIKey RMTKDRALWKWPRC-UHFFFAOYSA-N
Molecular Weight 197.146 g/mol
SMILES Oc1c(C(=O)O)ccc(c1N(=O)=O)C
SPLASH splash10-004i-5900000000-a939d0cf32d9f820d09f
Wiley ID 1478774