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Benzyl-penilloic acid, anion

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Benzyl-penilloic acid, anion
SpectraBase Compound ID 93BdGHOIBfD
InChI InChI=1S/C15H20N2O3S/c1-15(2)13(14(19)20)17-12(21-15)9-16-11(18)8-10-6-4-3-5-7-10/h3-7,12-13,17H,8-9H2,1-2H3,(H,16,18)(H,19,20)/p-1
InChIKey LRWFMQCGNBOTQP-UHFFFAOYSA-M
Mol Weight 307.39 g/mol
Molecular Formula C15H19N2O3S
Exact Mass 307.111639 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JO5Jki6E3OS
Name Benzyl-penilloic acid, anion
Comments SODIUM SALT, ISOMER ABSORPTIONS AT 59.7, 75.1, 66.2, 43.2, 29.0, 29.4, 176.1 PPM
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Formula C15H19N2O3S
InChI InChI=1S/C15H20N2O3S/c1-15(2)13(14(19)20)17-12(21-15)9-16-11(18)8-10-6-4-3-5-7-10/h3-7,12-13,17H,8-9H2,1-2H3,(H,16,18)(H,19,20)/p-1
InChIKey LRWFMQCGNBOTQP-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