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Trimethylsilyl 3,3-dimethyl-7-oxo-6-[(2-phenoxybutanoyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

View entire compound with spectra: 1 NMR

Trimethylsilyl 3,3-dimethyl-7-oxo-6-[(2-phenoxybutanoyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
SpectraBase Compound ID DgbFPIFqkGj
InChI InChI=1S/C21H30N2O5SSi/c1-7-14(27-13-11-9-8-10-12-13)17(24)22-15-18(25)23-16(20(26)28-30(4,5)6)21(2,3)29-19(15)23/h8-12,14-16,19H,7H2,1-6H3,(H,22,24)
InChIKey FNPPABKJIHVCLB-UHFFFAOYSA-N
Mol Weight 450.63 g/mol
Molecular Formula C21H30N2O5SSi
Exact Mass 450.16447 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G54tNZPuJlx
Name Trimethylsilyl 3,3-dimethyl-7-oxo-6-[(2-phenoxybutanoyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 450.164469778 u
Formula C21H30N2O5SSi
InChI InChI=1S/C21H30N2O5SSi/c1-7-14(27-13-11-9-8-10-12-13)17(24)22-15-18(25)23-16(20(26)28-30(4,5)6)21(2,3)29-19(15)23/h8-12,14-16,19H,7H2,1-6H3,(H,22,24)
InChIKey FNPPABKJIHVCLB-UHFFFAOYSA-N
Molecular Weight 450.625 g/mol
SMILES CCC(C(NC1C2SC(C)(C)C(N2C1=O)C(O[Si](C)(C)C)=O)=O)OC1=CC=CC=C1