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3-ALPHA-ACETOXYMETHYL-3-BETA-HYDROXY-1-OXACEPHAM-BENZHYDRYLESTER
SpectraBase Compound ID JLxlAQMss08
InChI InChI=1S/C30H28N2O8/c1-19(33)38-17-30(37)18-39-28-23(31-26(34)22-15-9-4-10-16-22)27(35)32(28)25(30)29(36)40-24(20-11-5-2-6-12-20)21-13-7-3-8-14-21/h2-16,23-25,28,37H,17-18H2,1H3,(H,31,34)
InChIKey WGAIRNARZYQZRU-UHFFFAOYSA-N
Mol Weight 544.56 g/mol
Molecular Formula C30H28N2O8
Exact Mass 544.184566 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID o3deXnrWJs
Name 3-ALPHA-ACETOXYMETHYL-3-BETA-HYDROXY-1-OXACEPHAM-BENZHYDRYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H28N2O8
InChI InChI=1S/C30H28N2O8/c1-19(33)38-17-30(37)18-39-28-23(31-26(34)22-15-9-4-10-16-22)27(35)32(28)25(30)29(36)40-24(20-11-5-2-6-12-20)21-13-7-3-8-14-21/h2-16,23-25,28,37H,17-18H2,1H3,(H,31,34)
InChIKey WGAIRNARZYQZRU-UHFFFAOYSA-N
Literature Reference Author T.AOKI,W.NAGATA,Y.YOSHIMURA,J.NISHIKAWA,K.TORI
Literature Reference Citation HETEROCYCLES,25,321(1987)
Literature Reference DOI 10.3987/S-1987-01-0321
Molecular Weight 544.561 g/mol
Solvent DMSO-D6
Source File Reference UWED5070