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7b-(Thiophene-2-acetamido)-3-([(5-me-1,3,4-thiadiazol-2-yl)thio]me)-3-cephem-4-cooh me ester S-1,S-2 disulfone
SpectraBase Compound ID 7T9VcgCObDA
InChI InChI=1S/C18H18N4O8S4/c1-9-20-21-18(32-9)34(28,29)8-10-7-33(26,27)16-13(15(24)22(16)14(10)17(25)30-2)19-12(23)6-11-4-3-5-31-11/h3-5,13,16H,6-8H2,1-2H3,(H,19,23)
InChIKey QDFGLRCCPKGZQC-UHFFFAOYSA-N
Mol Weight 546.6 g/mol
Molecular Formula C18H18N4O8S4
Exact Mass 546.000748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AzbXTUIFMbR
Name 7b-(Thiophene-2-acetamido)-3-([(5-me-1,3,4-thiadiazol-2-yl)thio]me)-3-cephem-4-cooh me ester S-1,S-2 disulfone
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H18N4O8S4
InChI InChI=1S/C18H18N4O8S4/c1-9-20-21-18(32-9)34(28,29)8-10-7-33(26,27)16-13(15(24)22(16)14(10)17(25)30-2)19-12(23)6-11-4-3-5-31-11/h3-5,13,16H,6-8H2,1-2H3,(H,19,23)
InChIKey QDFGLRCCPKGZQC-UHFFFAOYSA-N
Instrument Name Bruker AM-300
Literature Reference M. Lee, R.G. Micetich, R. Singh, Magn. Res. Chem. 26, 719 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6