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Oxacillin anion

View entire compound with spectra: 2 NMR

Oxacillin anion
SpectraBase Compound ID ExfFQwYCfmz
InChI InChI=1S/C19H19N3O5S/c1-9-11(12(21-27-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)28-17(13)22/h4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26)/p-1
InChIKey UWYHMGVUTGAWSP-UHFFFAOYSA-M
Mol Weight 400.43 g/mol
Molecular Formula C19H18N3O5S
Exact Mass 400.096717 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2jfhMWc4aO5
Name Oxacillin anion
Comments Na salt, C6 AX
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Formula C19H18N3O5S
InChI InChI=1S/C19H19N3O5S/c1-9-11(12(21-27-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)28-17(13)22/h4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26)/p-1
InChIKey UWYHMGVUTGAWSP-UHFFFAOYSA-M
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