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[2-[(S)-2-OXO-4-PHENYLAZETIDIN-1-YL]-ACETYL]-L-ALANINE-PHENYLESTER

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[2-[(S)-2-OXO-4-PHENYLAZETIDIN-1-YL]-ACETYL]-L-ALANINE-PHENYLESTER
SpectraBase Compound ID FRTCtQVwAKF
InChI InChI=1S/C40H38N4O8/c45-35(25-43-33(23-37(43)47)27-13-5-1-6-14-27)41-31(39(49)51-29-17-9-3-10-18-29)21-22-32(40(50)52-30-19-11-4-12-20-30)42-36(46)26-44-34(24-38(44)48)28-15-7-2-8-16-28/h1-20,31-34H,21-26H2,(H,41,45)(H,42,46)
InChIKey JKDJQPZMFUBLBP-UHFFFAOYSA-N
Mol Weight 702.8 g/mol
Molecular Formula C40H38N4O8
Exact Mass 702.268964 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Li3w4IKBim
Name [2-[(S)-2-OXO-4-PHENYLAZETIDIN-1-YL]-ACETYL]-L-ALANINE-PHENYLESTER
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H38N4O8
InChI InChI=1S/C40H38N4O8/c45-35(25-43-33(23-37(43)47)27-13-5-1-6-14-27)41-31(39(49)51-29-17-9-3-10-18-29)21-22-32(40(50)52-30-19-11-4-12-20-30)42-36(46)26-44-34(24-38(44)48)28-15-7-2-8-16-28/h1-20,31-34H,21-26H2,(H,41,45)(H,42,46)
InChIKey JKDJQPZMFUBLBP-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 702.764 g/mol
Solvent CDCl3