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Cyclotri(prolinyl-glycine)
SpectraBase Compound ID eTZb5Q3B1W
InChI InChI=1S/C21H30N6O6/c28-16-10-23-20(32)14-5-2-9-27(14)18(30)12-24-21(33)15-6-3-8-26(15)17(29)11-22-19(31)13-4-1-7-25(13)16/h13-15H,1-12H2,(H,22,31)(H,23,32)(H,24,33)
InChIKey WAOABPNIJIPSKM-UHFFFAOYSA-N
Mol Weight 462.51 g/mol
Molecular Formula C21H30N6O6
Exact Mass 462.222683 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 259W5FQSkMq
Name Cyclotri(prolinyl-glycine)
CAS Registry Number 37783-51-0
Comments SOLVENT IS CH3CN/CHCL3 WITH 66% MG(CLO4)2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H30N6O6
InChI InChI=1S/C21H30N6O6/c28-16-10-23-20(32)14-5-2-9-27(14)18(30)12-24-21(33)15-6-3-8-26(15)17(29)11-22-19(31)13-4-1-7-25(13)16/h13-15H,1-12H2,(H,22,31)(H,23,32)(H,24,33)
InChIKey WAOABPNIJIPSKM-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference V. Madison, M. Atreyi, C.M. Deber, J. Am. Chem. Soc. 96, 6725 (1974).
NMR Standard CS2
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Mixture