1-[5-(4-bromo-phenyl)-thiazol-2-yl]-pyrrolidine-2-carboxylic acid benzyl ester

SpectraBase Compound ID	1QFqg47uIT2
InChI	InChI=1S/C21H19BrN2O2S/c22-17-10-8-16(9-11-17)19-13-23-21(27-19)24-12-4-7-18(24)20(25)26-14-15-5-2-1-3-6-15/h1-3,5-6,8-11,13,18H,4,7,12,14H2
InChIKey	HHGJEJUZDDWMHI-UHFFFAOYSA-N Google Search
Mol Weight	443.36 g/mol
Molecular Formula	C21H19BrN2O2S
Exact Mass	442.035062 g/mol

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SpectraBase Spectrum ID	1GAP0cyLU4S
Name	1-[5-(4-bromo-phenyl)-thiazol-2-yl]-pyrrolidine-2-carboxylic acid benzyl ester
Alternate Name(s)	Benzyl 1-[5-(4-bromophenyl)-1,3-thiazol-2-yl]-2-pyrrolidinecarboxylate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H19BrN2O2S
InChI	InChI=1S/C21H19BrN2O2S/c22-17-10-8-16(9-11-17)19-13-23-21(27-19)24-12-4-7-18(24)20(25)26-14-15-5-2-1-3-6-15/h1-3,5-6,8-11,13,18H,4,7,12,14H2
InChIKey	HHGJEJUZDDWMHI-UHFFFAOYSA-N
Molecular Weight	443.359 g/mol
SMILES	c1(N2C(C(OCc3ccccc3)=O)CCC2)sc(-c2ccc(cc2)Br)cn1
SPLASH	splash10-0a4i-5429100000-835cc17934d5df26d6c7
Wiley ID	1455119