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7b-Phthalimido-3-methyl-cephem-3-ic 4-acid, methyl ester
SpectraBase Compound ID ARhwT9UD5GS
InChI InChI=1S/C17H14N2O5S/c1-8-7-25-16-12(15(22)19(16)11(8)17(23)24-2)18-13(20)9-5-3-4-6-10(9)14(18)21/h3-6,12,16H,7H2,1-2H3
InChIKey PBRCJCQXPAJPEL-UHFFFAOYSA-N
Mol Weight 358.37 g/mol
Molecular Formula C17H14N2O5S
Exact Mass 358.062343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CFiNlsMN8Wd
Name 7b-Phthalimido-3-methyl-cephem-3-ic 4-acid, methyl ester
CAS Registry Number 38584-05-3
Comments C7 AND C8 SHIFTVALUE IS CHANGED FROM 160.90 TO 166.90 PPM (A.H.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H14N2O5S
InChI InChI=1S/C17H14N2O5S/c1-8-7-25-16-12(15(22)19(16)11(8)17(23)24-2)18-13(20)9-5-3-4-6-10(9)14(18)21/h3-6,12,16H,7H2,1-2H3
InChIKey PBRCJCQXPAJPEL-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