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6-{[2-(p-chlorophenyl)-N-cyanoacetimidoyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3,2,0]heptane-2-carboxylic acid, hydroxymethyl ester, pivalate(ester)
SpectraBase Compound ID LltcstlrIl2
InChI InChI=1S/C23H27ClN4O5S/c1-22(2,3)21(31)33-12-32-20(30)17-23(4,5)34-19-16(18(29)28(17)19)27-15(26-11-25)10-13-6-8-14(24)9-7-13/h6-9,16-17,19H,10,12H2,1-5H3,(H,26,27)/t16-,17?,19-/m1/s1
InChIKey AGSQDFGYWCKZQP-IRQCGSAXSA-N
Mol Weight 507.01 g/mol
Molecular Formula C23H27ClN4O5S
Exact Mass 506.139069 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CPzaasVtysn
Name 6-{[2-(p-chlorophenyl)-N-cyanoacetimidoyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, hydroxymethyl ester, pivalate(ester)
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Formula C23H27ClN4O5S
InChI InChI=1S/C23H27ClN4O5S/c1-22(2,3)21(31)33-12-32-20(30)17-23(4,5)34-19-16(18(29)28(17)19)27-15(26-11-25)10-13-6-8-14(24)9-7-13/h6-9,16-17,19H,10,12H2,1-5H3,(H,26,27)/t16-,17?,19-/m1/s1
InChIKey AGSQDFGYWCKZQP-IRQCGSAXSA-N
Instrument Name Varian A-60
Sadtler NMR Number 22401M
Solvent Polysol