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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-sulfoxide S-2-sulfone
SpectraBase Compound ID IjAdljNQUIr
InChI InChI=1S/C18H18N4O7S4/c1-9-20-21-18(31-9)33(27,28)8-10-7-32(26)16-13(15(24)22(16)14(10)17(25)29-2)19-12(23)6-11-4-3-5-30-11/h3-5,13,16H,6-8H2,1-2H3,(H,19,23)
InChIKey LFZXLSRFKFBPQZ-UHFFFAOYSA-N
Mol Weight 530.6 g/mol
Molecular Formula C18H18N4O7S4
Exact Mass 530.005834 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FFbyNFkRZkg
Name 7b-(Thiophene-2-acetamido)-3-([5-me-1,3,4-thiadiazol-2-yl)thio]me)-3-cephem-4-cooh me ester S-1-sulfoxide S-2-sulfone
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Formula C18H18N4O7S4
InChI InChI=1S/C18H18N4O7S4/c1-9-20-21-18(31-9)33(27,28)8-10-7-32(26)16-13(15(24)22(16)14(10)17(25)29-2)19-12(23)6-11-4-3-5-30-11/h3-5,13,16H,6-8H2,1-2H3,(H,19,23)
InChIKey LFZXLSRFKFBPQZ-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