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Cephazolin anion

View entire compound with spectra: 2 NMR

Cephazolin anion
SpectraBase Compound ID 3Mc2ZLrDRF2
InChI InChI=1S/C14H14N8O4S3/c1-6-17-18-14(29-6)28-4-7-3-27-12-9(11(24)22(12)10(7)13(25)26)16-8(23)2-21-5-15-19-20-21/h5,9,12H,2-4H2,1H3,(H,16,23)(H,25,26)/p-1
InChIKey MLYYVTUWGNIJIB-UHFFFAOYSA-M
Mol Weight 453.49 g/mol
Molecular Formula C14H13N8O4S3
Exact Mass 453.022189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3TkHb3AMqTa
Name Cephazolin anion
Comments SODIUM SALT, FROM TORI
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Formula C14H13N8O4S3
InChI InChI=1S/C14H14N8O4S3/c1-6-17-18-14(29-6)28-4-7-3-27-12-9(11(24)22(12)10(7)13(25)26)16-8(23)2-21-5-15-19-20-21/h5,9,12H,2-4H2,1H3,(H,16,23)(H,25,26)/p-1
InChIKey MLYYVTUWGNIJIB-UHFFFAOYSA-M
Literature Reference S.K. Branch, A.F. Casy, A. Lipczynski, Magn. Res. Chem. 24, 465 (1986).
NMR Standard CH3OH
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O