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3-Hydroxy-4-nitro-naphthalene-2-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

3-Hydroxy-4-nitro-naphthalene-2-carboxylic acid methyl ester
SpectraBase Compound ID 3BUlquzbBaD
InChI InChI=1S/C12H9NO5/c1-18-12(15)9-6-7-4-2-3-5-8(7)10(11(9)14)13(16)17/h2-6,14H,1H3
InChIKey SMEAMGOZNIOEDU-UHFFFAOYSA-N
Mol Weight 247.21 g/mol
Molecular Formula C12H9NO5
Exact Mass 247.048072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34Q1NYCibrJ
Name 3-Hydroxy-4-nitro-naphthalene-2-carboxylic acid methyl ester
Alternate Name(s) 3-Hydroxy-4-nitro-2-naphthalenecarboxylic acid methyl ester Methyl 3-hydroxy-4-nitro-2-naphthoate Methyl 3-hydroxy-4-nitro-naphthalene-2-carboxylate Methyl 4-nitro-3-oxidanyl-naphthalene-2-carboxylate
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Formula C12H9NO5
InChI InChI=1S/C12H9NO5/c1-18-12(15)9-6-7-4-2-3-5-8(7)10(11(9)14)13(16)17/h2-6,14H,1H3
InChIKey SMEAMGOZNIOEDU-UHFFFAOYSA-N
Molecular Weight 247.206 g/mol
SMILES Oc1c(C(=O)OC)cc2c(c1N(=O)=O)cccc2
SPLASH splash10-0901-5940000000-3b642fe2b02955937117
Wiley ID 1437506