N-[3-(BENZYLTHIO)-N-CARBOXY-L-ALANYL]GLYCINE, N-BENZYL ETHYL ESTER

SpectraBase Compound ID	J7HYleT2KU
InChI	InChI=1S/C22H26N2O5S/c1-2-28-20(25)13-23-21(26)19(16-30-15-18-11-7-4-8-12-18)24-22(27)29-14-17-9-5-3-6-10-17/h3-12,19H,2,13-16H2,1H3,(H,23,26)(H,24,27)
InChIKey	LUMMBUACNDKBJC-UHFFFAOYSA-N Google Search
Mol Weight	430.52 g/mol
Molecular Formula	C22H26N2O5S
Exact Mass	430.156243 g/mol

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SpectraBase Spectrum ID	I7Io6bpAOo3
Name	N-[3-(BENZYLTHIO)-N-CARBOXY-L-ALANYL]GLYCINE, N-BENZYL ETHYL ESTER
Source of Sample	Frinton Laboratories, Inc., South Vineland, New Jersey
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H26N2O5S
InChI	InChI=1S/C22H26N2O5S/c1-2-28-20(25)13-23-21(26)19(16-30-15-18-11-7-4-8-12-18)24-22(27)29-14-17-9-5-3-6-10-17/h3-12,19H,2,13-16H2,1H3,(H,23,26)(H,24,27)
InChIKey	LUMMBUACNDKBJC-UHFFFAOYSA-N
Melting Point	96.5-98C
Molecular Weight	430.519012
Optical Properties	Optical Rotation= (20C) -35 DEG (c=2, ALCOHOL)
Synonyms	GLYCINE, N-/3-/BENZYLTHIO/-N- CARBOXY-L-ALANYL/-, N-BENZYL ETHYL ESTER
Technique	KBr WAFER