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Ethyl 2-(2-chloroacetamido)-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate
SpectraBase Compound ID 5auDe11Ss7
InChI InChI=1S/C17H17ClN2O4S/c1-3-24-17(23)13-10(2)14(25-16(13)20-12(21)9-18)15(22)19-11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H,19,22)(H,20,21)
InChIKey MZTSIJRGKUSACK-UHFFFAOYSA-N
Mol Weight 380.85 g/mol
Molecular Formula C17H17ClN2O4S
Exact Mass 380.059756 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hj25AivDe0i
Name Ethyl 2-(2-chloroacetamido)-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate
Appearance Yellow crystals
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Formula C17H17ClN2O4S
InChI InChI=1S/C17H17ClN2O4S/c1-3-24-17(23)13-10(2)14(25-16(13)20-12(21)9-18)15(22)19-11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H,19,22)(H,20,21)
InChIKey MZTSIJRGKUSACK-UHFFFAOYSA-N
Instrument Name Finnegan MAT 212
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2622
Molecular Weight 380.846 g/mol
SMILES N(C(c1c(c(c(s1)NC(CCl)=O)C(OCC)=O)C)=O)c1ccccc1
SPLASH splash10-000i-2191000000-762f4de87c2929dae305
Source of Spectrum Y-54-567-20
Wiley ID 1880699