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2-[(2-nitro-3-thienyl)oxy]benzoic acid methyl ester
SpectraBase Compound ID CQJr6k1TbQZ
InChI InChI=1S/C12H9NO5S/c1-17-12(14)8-4-2-3-5-9(8)18-10-6-7-19-11(10)13(15)16/h2-7H,1H3
InChIKey YXMHWKQPCQYFPX-UHFFFAOYSA-N
Mol Weight 279.27 g/mol
Molecular Formula C12H9NO5S
Exact Mass 279.020144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JwRCdBdPAhG
Name 2-[(2-nitro-3-thienyl)oxy]benzoic acid methyl ester
Alternate Name(s) 2-[(2-nitro-3-thiophenyl)oxy]benzoic acid methyl ester Methyl 2-(2-nitrothiophen-3-yl)oxybenzoate Methyl 2-[(2-nitro-3-thienyl)oxy]benzoate
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Formula C12H9NO5S
InChI InChI=1S/C12H9NO5S/c1-17-12(14)8-4-2-3-5-9(8)18-10-6-7-19-11(10)13(15)16/h2-7H,1H3
InChIKey YXMHWKQPCQYFPX-UHFFFAOYSA-N
Molecular Weight 279.266 g/mol
SMILES c1(N(=O)=O)c(Oc2c(C(=O)OC)cccc2)ccs1
SPLASH splash10-004i-0930000000-45023ec91e7a29ecfc44
Source of Spectrum Y-31-1059-21
Wiley ID 761688