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PARA-NITROBENZYL-(6R,7R)-7-PHENOXYACETYLAMINOCEPH-3-EM-4-CARBOXYLATE

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PARA-NITROBENZYL-(6R,7R)-7-PHENOXYACETYLAMINOCEPH-3-EM-4-CARBOXYLATE
SpectraBase Compound ID AHZ1zsmNFbP
InChI InChI=1S/C23H21N3O7S/c1-14-13-34-22-19(24-18(27)12-32-17-5-3-2-4-6-17)21(28)25(22)20(14)23(29)33-11-15-7-9-16(10-8-15)26(30)31/h2-10,19,22H,11-13H2,1H3,(H,24,27)
InChIKey YSJGVKHCAVGBIT-UHFFFAOYSA-N
Mol Weight 483.5 g/mol
Molecular Formula C23H21N3O7S
Exact Mass 483.110021 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ACMDC3mPnLn
Name 7b-Phenoxyacetamido-3-methyl-cephem-3-ic 4-acid, methyl ester
CAS Registry Number 28974-31-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H21N3O7S
InChI InChI=1S/C23H21N3O7S/c1-14-13-34-22-19(24-18(27)12-32-17-5-3-2-4-6-17)21(28)25(22)20(14)23(29)33-11-15-7-9-16(10-8-15)26(30)31/h2-10,19,22H,11-13H2,1H3,(H,24,27)
InChIKey YSJGVKHCAVGBIT-UHFFFAOYSA-N
Instrument Name Jeol PS-100
Literature Reference S. Kukolja, N.D. Jones, D.E. Dorman, J. Org. Chem. 40, 2388 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3