L-(-)-N-(N-CARBOXY-L-ISOLEUCYL)METHIONINE, N-BENZYL ESTER

SpectraBase Compound ID	BD4r1xjPVAv
InChI	InChI=1S/C19H28N2O5S/c1-4-13(2)16(17(22)20-15(18(23)24)10-11-27-3)21-19(25)26-12-14-8-6-5-7-9-14/h5-9,13,15-16H,4,10-12H2,1-3H3,(H,20,22)(H,21,25)(H,23,24)/t13?,15-,16-/m0/s1
InChIKey	GTXSTEDIVHHJQL-FMYDAXTQSA-N Google Search
Mol Weight	396.5 g/mol
Molecular Formula	C19H28N2O5S
Exact Mass	396.171893 g/mol

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SpectraBase Spectrum ID	ApHHtYdESsU
Name	L-(-)-N-(N-CARBOXY-L-ISOLEUCYL)METHIONINE, N-BENZYL ESTER
Source of Sample	Fluka Chemie AG, Buchs, Switzerland
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C19H28N2O5S
InChI	InChI=1S/C19H28N2O5S/c1-4-13(2)16(17(22)20-15(18(23)24)10-11-27-3)21-19(25)26-12-14-8-6-5-7-9-14/h5-9,13,15-16H,4,10-12H2,1-3H3,(H,20,22)(H,21,25)(H,23,24)/t13?,15-,16-/m0/s1
InChIKey	GTXSTEDIVHHJQL-FMYDAXTQSA-N
Melting Point	145-148C
Molecular Weight	396.502014
Optical Properties	Optical Rotation= (20C) -24.5 +/- 1 DEG (c=2, METHANOL)
Synonyms	METHIONINE, N-/N-CARBOXY-L-ISO- LEUCYL/-, N-BENZYL ESTER, L-/MINUS/-,
Technique	KBr WAFER