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[2-[(R)-2-OXO-4-PHENYLAZETIDIN-1-YL]-ACETYL]-L-VALYL-L-PROLYL-L-ALANINE-BENZYLESTER

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[2-[(R)-2-OXO-4-PHENYLAZETIDIN-1-YL]-ACETYL]-L-VALYL-L-PROLYL-L-ALANINE-BENZYLESTER
SpectraBase Compound ID KKj1GaiTw13
InChI InChI=1S/C31H38N4O6/c1-20(2)28(33-26(36)18-35-25(17-27(35)37)23-13-8-5-9-14-23)30(39)34-16-10-15-24(34)29(38)32-21(3)31(40)41-19-22-11-6-4-7-12-22/h4-9,11-14,20-21,24-25,28H,10,15-19H2,1-3H3,(H,32,38)(H,33,36)
InChIKey NRJDPBHQOAOZJQ-UHFFFAOYSA-N
Mol Weight 562.7 g/mol
Molecular Formula C31H38N4O6
Exact Mass 562.279135 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KXzojSOJQ0m
Name [2-[(R)-2-OXO-4-PHENYLAZETIDIN-1-YL]-ACETYL]-L-VALYL-L-PROLYL-L-ALANINE-BENZYLESTER
Compound Number 31
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H38N4O6
InChI InChI=1S/C31H38N4O6/c1-20(2)28(33-26(36)18-35-25(17-27(35)37)23-13-8-5-9-14-23)30(39)34-16-10-15-24(34)29(38)32-21(3)31(40)41-19-22-11-6-4-7-12-22/h4-9,11-14,20-21,24-25,28H,10,15-19H2,1-3H3,(H,32,38)(H,33,36)
InChIKey NRJDPBHQOAOZJQ-UHFFFAOYSA-N
Literature Reference Author K.ACHILLES,T.SCHIRMEISTER,H.H.OTTO
Literature Reference Citation ARCH.PHARM.,333,243(2000)
Literature Reference DOI 10.1002/1521-4184(20008)333:8<243::aid-ardp243>3.3.co;2-f
Molecular Weight 562.666 g/mol
Solvent CDCl3