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2-[4-(Ethoxycarbonyl)-2-(benzoylimino)thiazol-3(2H)-yl]propanoic acid
SpectraBase Compound ID BHIHLVnHHlA
InChI InChI=1S/C16H16N2O5S/c1-3-23-15(22)12-9-24-16(18(12)10(2)14(20)21)17-13(19)11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H,20,21)/b17-16-
InChIKey ZATIHDKOYHAQIV-MSUUIHNZSA-N
Mol Weight 348.37 g/mol
Molecular Formula C16H16N2O5S
Exact Mass 348.077993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrusXGP0yPC
Name 2-[4-(Ethoxycarbonyl)-2-(benzoylimino)thiazol-3(2H)-yl]propanoic acid
Alternate Name(s) (Z)-2-(2-(benzoylimino)-4-(ethoxycarbonyl)thiazol-3(2H)-yl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N2O5S
InChI InChI=1S/C16H16N2O5S/c1-3-23-15(22)12-9-24-16(18(12)10(2)14(20)21)17-13(19)11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H,20,21)/b17-16-
InChIKey ZATIHDKOYHAQIV-MSUUIHNZSA-N
Literature Reference DOI 10.1016/j.cclet.2013.11.009
Molecular Weight 348.373 g/mol
SMILES OC(C(N1C(=CS\C1=N\C(c1ccccc1)=O)C(=O)OCC)C)=O
SPLASH splash10-0a91-9760000000-8e85d67ae656cb90788d
Source of Spectrum CCL-25-120-4d
Wiley ID 1743746