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Methyl 2-[1-N-(benzyloxycarbonyl)amino-2-phenylethyl]thiazoline-4-carboxylate
SpectraBase Compound ID 5rZl79BbWeH
InChI InChI=1S/C21H22N2O4S/c1-26-20(24)18-14-28-19(22-18)17(12-15-8-4-2-5-9-15)23-21(25)27-13-16-10-6-3-7-11-16/h2-11,17-18H,12-14H2,1H3,(H,23,25)
InChIKey MHWHKRNARCCCAA-UHFFFAOYSA-N
Mol Weight 398.48 g/mol
Molecular Formula C21H22N2O4S
Exact Mass 398.130028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CD61wHMDmHb
Name Methyl 2-[1-N-(benzyloxycarbonyl)amino-2-phenylethyl]thiazoline-4-carboxylate
Alternate Name(s) Methyl 2-(1-{[(benzyloxy)carbonyl]amino}-2-phenylethyl)-4,5-dihydro-1,3-thiazole-4-carboxylate
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Formula C21H22N2O4S
InChI InChI=1S/C21H22N2O4S/c1-26-20(24)18-14-28-19(22-18)17(12-15-8-4-2-5-9-15)23-21(25)27-13-16-10-6-3-7-11-16/h2-11,17-18H,12-14H2,1H3,(H,23,25)
InChIKey MHWHKRNARCCCAA-UHFFFAOYSA-N
Molecular Weight 398.477 g/mol
SMILES N(C(=O)OCc1ccccc1)C(C1=NC(C(=O)OC)CS1)Cc1ccccc1
SPLASH splash10-0006-9121000000-5c2ae4987edc3c4d4013
Source of Spectrum AT-35-5400-2
Wiley ID 852858