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(2R,3R/2S,3S)-1-[N-(TERT.-BUTOXYCARBONYL)-(S)-PHENYLALANYL]-AZIRIDINE-2,3-DICARBOXYLIC-ACID
SpectraBase Compound ID I1hUON7QtoE
InChI InChI=1S/2C18H22N2O7/c2*1-18(2,3)27-17(26)19-11(9-10-7-5-4-6-8-10)14(21)20-12(15(22)23)13(20)16(24)25/h2*4-8,11-13H,9H2,1-3H3,(H,19,26)(H,22,23)(H,24,25)/t2*11?,12-,13-/m10/s1
InChIKey CAZNBHMKWQGHRF-JMOFKJLBSA-N
Mol Weight 756.76 g/mol
Molecular Formula C36H44N4O14
Exact Mass 756.285402 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID e4QNyZvXmP
Name (2R,3R/2S,3S)-1-[N-(TERT.-BUTOXYCARBONYL)-(S)-PHENYLALANYL]-AZIRIDINE-2,3-DICARBOXYLIC-ACID
Compound Number 19A+ B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H44N4O14
InChI InChI=1S/2C18H22N2O7/c2*1-18(2,3)27-17(26)19-11(9-10-7-5-4-6-8-10)14(21)20-12(15(22)23)13(20)16(24)25/h2*4-8,11-13H,9H2,1-3H3,(H,19,26)(H,22,23)(H,24,25)/t2*11?,12-,13-/m10/s1
InChIKey CAZNBHMKWQGHRF-JMOFKJLBSA-N
Literature Reference Author T.SCHIRMEISTER,M.PERIC
Literature Reference Citation BIOORG.MED.CHEM.,8,1281(2000)
Literature Reference DOI 10.1016/S0968-0896(00)00058-4
Molecular Weight 756.764 g/mol
Solvent CDCl3
Source File Reference UWVN20242