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Ethyl 2-amino-4-phenylthiazole-5-carboxylate
SpectraBase Compound ID BTt86dtruA2
InChI InChI=1S/C12H12N2O2S/c1-2-16-11(15)10-9(14-12(13)17-10)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H2,13,14)
InChIKey OZMXFXOHCUEEPD-UHFFFAOYSA-N
Mol Weight 248.3 g/mol
Molecular Formula C12H12N2O2S
Exact Mass 248.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hyo5ix2CMkM
Name 5-Thiazolecarboxylic acid, 2-amino-4-phenyl-, ethyl ester
Alternate Name(s) Ethyl 2-imino-4-phenyl-2,3-dihydro-1,3-thiazole-5-carboxylate
CAS Registry Number 64399-23-1
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2O2S
InChI InChI=1S/C12H12N2O2S/c1-2-16-11(15)10-9(14-12(13)17-10)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H2,13,14)
InChIKey OZMXFXOHCUEEPD-UHFFFAOYSA-N
Molecular Weight 248.300 g/mol
SMILES N1C(SC(C(OCC)=O)=C1c1ccccc1)=N
SPLASH splash10-0fba-8960000000-2011b8b720f5d1d48936
Source of Spectrum W5-21636-0-0
Wiley ID 1250728