2-Hexenoic acid, (4S)-4-[(t-butoxycarbonyl)-(S)-phenylalanyl)amino]-5-methyl, methyl ester

SpectraBase Compound ID	ISrtZC4u4vY
InChI	InChI=1S/C22H32N2O5/c1-15(2)17(12-13-19(25)28-6)23-20(26)18(14-16-10-8-7-9-11-16)24-21(27)29-22(3,4)5/h7-13,15,17-18H,14H2,1-6H3,(H,23,26)(H,24,27)/b13-12+
InChIKey	SLBLYZIJGAKSPU-OUKQBFOZSA-N Google Search
Mol Weight	404.5 g/mol
Molecular Formula	C22H32N2O5
Exact Mass	404.231122 g/mol

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SpectraBase Spectrum ID	IPnN76YZUAS
Name	2-HEXENOIC ACID, (4S)-4-[(tert-BUTYLOXYCARBONYL-(S)-PHENYLALANYL)AMINO]-5-METHYL, METHYL ESTER
Copyright	Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C22H32N2O5
InChI	InChI=1S/C22H32N2O5/c1-15(2)17(12-13-19(25)28-6)23-20(26)18(14-16-10-8-7-9-11-16)24-21(27)29-22(3,4)5/h7-13,15,17-18H,14H2,1-6H3,(H,23,26)(H,24,27)/b13-12+
InChIKey	SLBLYZIJGAKSPU-OUKQBFOZSA-N
Instrument Name	311A
Molecular Weight	404.2303
SMILES	N(C(C(NC(C(C)C)\C=C\C(OC)=O)=O)Cc1ccccc1)C(=O)OC(C)(C)C
SPLASH	splash10-0c00-7910000000-7001fa28d5b57fabe3cc
Source of Spectrum	Chemical Concepts, A Wiley Division, Weinheim, Germany