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BENZYL-[(2R)-N-(TERT.-BUTOXYCARBONYL)-ALPHA-METHYL-GLUTAMYL]-GAMMA-SARCOSINATE-DIESTER;ROTAMER-#1
SpectraBase Compound ID ExwEDS6cNKY
InChI InChI=1S/C21H30N2O7/c1-21(2,3)30-20(27)22-16(19(26)28-5)11-12-17(24)23(4)13-18(25)29-14-15-9-7-6-8-10-15/h6-10,16H,11-14H2,1-5H3,(H,22,27)/t16-/m1/s1
InChIKey RUORSQHLSIISOL-MRXNPFEDSA-N
Mol Weight 422.48 g/mol
Molecular Formula C21H30N2O7
Exact Mass 422.205301 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Htc3wljFr3V
Name BENZYL-[(2R)-N-(TERT.-BUTOXYCARBONYL)-ALPHA-METHYL-GLUTAMYL]-GAMMA-SARCOSINATE-DIESTER;ROTAMER-#1
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30N2O7
InChI InChI=1S/C21H30N2O7/c1-21(2,3)30-20(27)22-16(19(26)28-5)11-12-17(24)23(4)13-18(25)29-14-15-9-7-6-8-10-15/h6-10,16H,11-14H2,1-5H3,(H,22,27)/t16-/m1/s1
InChIKey RUORSQHLSIISOL-MRXNPFEDSA-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 422.478 g/mol
Solvent CDCl3
Source File Reference UWCP9212