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BENZYL-BETA-ALANYL-[ALPHA-METHYL-(2R)-GLUTAMYL]-GAMMA-GLYCINATE-DIESTER-HYDROCHLORIDE
SpectraBase Compound ID 8SPYW52VR6G
InChI InChI=1S/C18H25N3O6.ClH/c1-26-18(25)14(21-16(23)9-10-19)7-8-15(22)20-11-17(24)27-12-13-5-3-2-4-6-13;/h2-6,14H,7-12,19H2,1H3,(H,20,22)(H,21,23);1H/t14-;/m1./s1
InChIKey BIOHXTSBLYWGSN-PFEQFJNWSA-N
Mol Weight 415.87 g/mol
Molecular Formula C18H26ClN3O6
Exact Mass 415.151013 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LgEjxdtxC66
Name BENZYL-BETA-ALANYL-[ALPHA-METHYL-(2R)-GLUTAMYL]-GAMMA-GLYCINATE-DIESTER-HYDROCHLORIDE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H26ClN3O6
InChI InChI=1S/C18H25N3O6.ClH/c1-26-18(25)14(21-16(23)9-10-19)7-8-15(22)20-11-17(24)27-12-13-5-3-2-4-6-13;/h2-6,14H,7-12,19H2,1H3,(H,20,22)(H,21,23);1H/t14-;/m1./s1
InChIKey BIOHXTSBLYWGSN-PFEQFJNWSA-N
Literature Reference Author A.P.MEHROTRA,K.L.WEBSTER,D.GANI
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2495(1997)
Literature Reference DOI 10.1039/a702407j
Molecular Weight 415.874 g/mol
Solvent D2O
Source File Reference UWCP9205