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2-[2-(Benzoylimino)-4-(4-methoxyphenyl)thiazol-3(2H)-yl]propanoic acid
SpectraBase Compound ID DydIlv3Wow1
InChI InChI=1S/C20H18N2O4S/c1-13(19(24)25)22-17(14-8-10-16(26-2)11-9-14)12-27-20(22)21-18(23)15-6-4-3-5-7-15/h3-13H,1-2H3,(H,24,25)/b21-20-
InChIKey PMKTVFDTNFYPHX-MRCUWXFGSA-N
Mol Weight 382.43 g/mol
Molecular Formula C20H18N2O4S
Exact Mass 382.098728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLcQdk0WDqV
Name 2-[2-(Benzoylimino)-4-(4-methoxyphenyl)thiazol-3(2H)-yl]propanoic acid
Alternate Name(s) (Z)-2-(2-(benzoylimino)-4-(4-methoxyphenyl)thiazol-3(2H)-yl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18N2O4S
InChI InChI=1S/C20H18N2O4S/c1-13(19(24)25)22-17(14-8-10-16(26-2)11-9-14)12-27-20(22)21-18(23)15-6-4-3-5-7-15/h3-13H,1-2H3,(H,24,25)/b21-20-
InChIKey PMKTVFDTNFYPHX-MRCUWXFGSA-N
Literature Reference DOI 10.1016/j.cclet.2013.11.009
Molecular Weight 382.434 g/mol
SMILES OC(C(C)N1C(=CS\C1=N\C(c1ccccc1)=O)c1ccc(cc1)OC)=O
SPLASH splash10-0a4i-8904000000-8bbdbfde9aceed4e8dde
Source of Spectrum CCL-25-120-4e
Wiley ID 1743747