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2-[(3-fluorophenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylic acid
SpectraBase Compound ID BkydwVVzCp5
InChI InChI=1S/C13H11FN2O2S2/c1-7-5-10(12(17)18)11(20-7)16-13(19)15-9-4-2-3-8(14)6-9/h2-6H,1H3,(H,17,18)(H2,15,16,19)
InChIKey GGQJZLDFUAIVPZ-UHFFFAOYSA-N
Mol Weight 310.36 g/mol
Molecular Formula C13H11FN2O2S2
Exact Mass 310.024598 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XyCWENk2gi
Name 2-[(3-fluorophenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11FN2O2S2
InChI InChI=1S/C13H11FN2O2S2/c1-7-5-10(12(17)18)11(20-7)16-13(19)15-9-4-2-3-8(14)6-9/h2-6H,1H3,(H,17,18)(H2,15,16,19)
InChIKey GGQJZLDFUAIVPZ-UHFFFAOYSA-N
Molecular Weight 310.361 g/mol
SMILES N(\C(=N\c1sc(cc1C(O)=O)C)S)c1cccc(c1)F
SPLASH splash10-0w29-4910000000-bec89c5cbe1afb578354
Synonyms 2-[(3-fluorophenyl)thiocarbamoylamino]-5-methyl-3-thenoic acid 2-[[(3-fluoroanilino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid Thiophene-3-carboxylic acid, 2-[3-(3-fluorophenyl)isothioureido]-5-methyl-
Wiley ID 1440887