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5-chloro-2-[(2-nitro-3-thienyl)oxy]benzoic acid methyl ester
SpectraBase Compound ID 5F3VV3HcZhm
InChI InChI=1S/C12H8ClNO5S/c1-18-12(15)8-6-7(13)2-3-9(8)19-10-4-5-20-11(10)14(16)17/h2-6H,1H3
InChIKey IMPOUBPZDHHYIS-UHFFFAOYSA-N
Mol Weight 313.71 g/mol
Molecular Formula C12H8ClNO5S
Exact Mass 312.981171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55bWKr9Bq3d
Name 5-chloro-2-[(2-nitro-3-thienyl)oxy]benzoic acid methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C12H8ClNO5S
InChI InChI=1S/C12H8ClNO5S/c1-18-12(15)8-6-7(13)2-3-9(8)19-10-4-5-20-11(10)14(16)17/h2-6H,1H3
InChIKey IMPOUBPZDHHYIS-UHFFFAOYSA-N
Molecular Weight 313.711 g/mol
SMILES c1(N(=O)=O)c(Oc2c(C(=O)OC)cc(cc2)Cl)ccs1
SPLASH splash10-004i-0900000000-127164b837b528bf8bc9
Source of Spectrum Y-31-1059-22
Synonyms 5-chloro-2-[(2-nitro-3-thiophenyl)oxy]benzoic acid methyl ester methyl 5-chloranyl-2-(2-nitrothiophen-3-yl)oxy-benzoate methyl 5-chloro-2-(2-nitrothiophen-3-yl)oxybenzoate methyl 5-chloro-2-[(2-nitro-3-thienyl)oxy]benzoate
Wiley ID 761687