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6-[(N-cyanoacetimidoyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, hydroxymethyl ester, pivalate(ester), hydrated

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 UV-Vis

6-[(N-cyanoacetimidoyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, hydroxymethyl ester, pivalate(ester), hydrated
SpectraBase Compound ID 24jALbZ0Pcv
InChI InChI=1S/6C17H24N4O5S.H2O/c6*1-9(19-7-18)20-10-12(22)21-11(17(5,6)27-13(10)21)14(23)25-8-26-15(24)16(2,3)4;/h6*10-11,13H,8H2,1-6H3,(H,19,20);1H2/t6*10-,11+,13-;/m111111./s1
InChIKey OYGSUHRODCZGIS-CVGDNWIJSA-N
Mol Weight 399.46 g/mol
Molecular Formula C17H24.3333N4O5.16667S
Exact Mass 399.148502 g/mol

Ultraviolet-Visible (UV-Vis) Spectrum

Ultraviolet-Visible (UV-Vis) Spectrum

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SpectraBase Spectrum ID JNbyjXZzqzm
Name 6-[(2-cyanoacetimidoyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-aza-bicyclo[3,2,0]heptane-2-carboxylic acid, hydroxymethyl ester, pivalate(ester), hydrated
Conditions Acidic
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Formula C17H26N4O6S
InChI InChI=1S/6C17H24N4O5S.H2O/c6*1-9(19-7-18)20-10-12(22)21-11(17(5,6)27-13(10)21)14(23)25-8-26-15(24)16(2,3)4;/h6*10-11,13H,8H2,1-6H3,(H,19,20);1H2/t6*10-,11+,13-;/m111111./s1
InChIKey OYGSUHRODCZGIS-CVGDNWIJSA-N
Sadtler IR Number 49856
Sadtler UV Number 25730A
Solvent Methanol