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Ethyl 2-(3-iodobenzamido)-4-phenyl-3-thiophenecarboxylate
SpectraBase Compound ID 4gHHSAISFWE
InChI InChI=1S/C20H16INO3S/c1-2-25-20(24)17-16(13-7-4-3-5-8-13)12-26-19(17)22-18(23)14-9-6-10-15(21)11-14/h3-12H,2H2,1H3,(H,22,23)
InChIKey DCDRNHYULFZCAT-UHFFFAOYSA-N
Mol Weight 477.32 g/mol
Molecular Formula C20H16INO3S
Exact Mass 476.98956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KxzCLTTZFCP
Name ETHYL 2-(3-IODOBENZAMIDO)-4-PHENYL-3-THIOPHENECARBOXYLATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H16INO3S
InChI InChI=1S/C20H16INO3S/c1-2-25-20(24)17-16(13-7-4-3-5-8-13)12-26-19(17)22-18(23)14-9-6-10-15(21)11-14/h3-12H,2H2,1H3,(H,22,23)
InChIKey DCDRNHYULFZCAT-UHFFFAOYSA-N
Molecular Weight 476.9851
SMILES N(C(c1cccc(I)c1)=O)c1scc(-c2ccccc2)c1C(OCC)=O
SPLASH splash10-0fc0-9440000000-ced686d585f70ea5ae51
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany