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(S)-2-[2-(Tert-butyldiphenylsilyloxy)-1-(2-methoxy-3-nitrophenyl)ethyl]isoindole-1,3-dione
SpectraBase Compound ID ABmKb7HqJUy
InChI InChI=1S/C33H32N2O6Si/c1-33(2,3)42(23-14-7-5-8-15-23,24-16-9-6-10-17-24)41-22-29(27-20-13-21-28(35(38)39)30(27)40-4)34-31(36)25-18-11-12-19-26(25)32(34)37/h5-21,29H,22H2,1-4H3/t29-/m1/s1
InChIKey YZSJVKPKVWHGJL-GDLZYMKVSA-N
Mol Weight 580.7 g/mol
Molecular Formula C33H32N2O6Si
Exact Mass 580.202963 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JAwnfQ0j9kE
Name (S)-2-[2-(Tert-butyldiphenylsilyloxy)-1-(2-methoxy-3-nitrophenyl)ethyl]isoindole-1,3-dione
Comments Computed using HOSE algorithm
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Exact Mass 580.202963287 u
Formula C33H32N2O6Si
InChI InChI=1S/C33H32N2O6Si/c1-33(2,3)42(23-14-7-5-8-15-23,24-16-9-6-10-17-24)41-22-29(27-20-13-21-28(35(38)39)30(27)40-4)34-31(36)25-18-11-12-19-26(25)32(34)37/h5-21,29H,22H2,1-4H3/t29-/m1/s1
InChIKey YZSJVKPKVWHGJL-GDLZYMKVSA-N
Molecular Weight 580.712 g/mol
SMILES C1(N(C(C=2C=CC=CC12)=O)[C@](CO[Si](C=1C=CC=CC1)(C=1C=CC=CC1)C(C)(C)C)(C=1C(=C(C=CC1)N(=O)=O)OC)[H])=O