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1-(1,3-Benzodioxol-5-yl)-5-oxo-3-pyrrolidinecarboxylic acid, tms derivative
SpectraBase Compound ID ERmgu1OVe3v
InChI InChI=1S/C15H19NO5Si/c1-22(2,3)21-15(18)10-6-14(17)16(8-10)11-4-5-12-13(7-11)20-9-19-12/h4-5,7,10H,6,8-9H2,1-3H3
InChIKey XOFRGNQQJUPAKN-UHFFFAOYSA-N
Mol Weight 321.4 g/mol
Molecular Formula C15H19NO5Si
Exact Mass 321.103249 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8beSIiHF7Mi
Name 1-(1,3-Benzodioxol-5-yl)-5-oxo-3-pyrrolidinecarboxylic acid, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 321.103249246 u
Formula C15H19NO5Si
InChI InChI=1S/C15H19NO5Si/c1-22(2,3)21-15(18)10-6-14(17)16(8-10)11-4-5-12-13(7-11)20-9-19-12/h4-5,7,10H,6,8-9H2,1-3H3
InChIKey XOFRGNQQJUPAKN-UHFFFAOYSA-N
Molecular Weight 321.404 g/mol
SMILES C1N(C(CC1C(=O)O[Si](C)(C)C)=O)C1=CC2=C(C=C1)OCO2