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Cephamandole anion

View entire compound with spectra: 1 NMR

Cephamandole anion
SpectraBase Compound ID EfK84fMtOsf
InChI InChI=1S/C18H18N6O5S2/c1-23-18(20-21-22-23)31-8-10-7-30-16-11(15(27)24(16)12(10)17(28)29)19-14(26)13(25)9-5-3-2-4-6-9/h2-6,11,13,16,25H,7-8H2,1H3,(H,19,26)(H,28,29)/p-1
InChIKey OLVCFLKTBJRLHI-UHFFFAOYSA-M
Mol Weight 461.49 g/mol
Molecular Formula C18H17N6O5S2
Exact Mass 461.070185 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D0JhQHew2PC
Name Cephamandole anion
Comments lithium salt
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Formula C18H17N6O5S2
InChI InChI=1S/C18H18N6O5S2/c1-23-18(20-21-22-23)31-8-10-7-30-16-11(15(27)24(16)12(10)17(28)29)19-14(26)13(25)9-5-3-2-4-6-9/h2-6,11,13,16,25H,7-8H2,1H3,(H,19,26)(H,28,29)/p-1
InChIKey OLVCFLKTBJRLHI-UHFFFAOYSA-M
Instrument Name Jeol FX-90
Literature Reference S.K. Branch, A.F. Casy, A. Lipczynski, Magn. Res. Chem. 24, 465 (1986).
NMR Standard TMS Ext.
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O