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(+-)-3-{1-[(tert-Butyldiphenylsilyl)oxyethyl]}isoquinoline
SpectraBase Compound ID F3oaJ7hSTfH
InChI InChI=1S/C27H29NOSi/c1-21(26-19-22-13-11-12-14-23(22)20-28-26)29-30(27(2,3)4,24-15-7-5-8-16-24)25-17-9-6-10-18-25/h5-21H,1-4H3
InChIKey ADODOOQQOUXEGE-UHFFFAOYSA-N
Mol Weight 411.62 g/mol
Molecular Formula C27H29NOSi
Exact Mass 411.201841 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8OZJ877ksO7
Name (+-)-3-{1-[(tert-butyldiphenylsilyl)oxyethyl]}isoquinoline
Comments Computed using HOSE algorithm
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Exact Mass 411.201841092 u
Formula C27H29NOSi
InChI InChI=1S/C27H29NOSi/c1-21(26-19-22-13-11-12-14-23(22)20-28-26)29-30(27(2,3)4,24-15-7-5-8-16-24)25-17-9-6-10-18-25/h5-21H,1-4H3
InChIKey ADODOOQQOUXEGE-UHFFFAOYSA-N
Molecular Weight 411.620 g/mol
SMILES C(O[Si](C(C)(C)C)(C1=CC=CC=C1)C=1C=CC=CC1)(C=1N=CC=2C(C1)=CC=CC2)C