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3-(1-Trityl-1H-imidazol-4-yl)propan-1-amine, 2tms

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3-(1-Trityl-1H-imidazol-4-yl)propan-1-amine, 2tms
SpectraBase Compound ID 1ASNmO4X3b3
InChI InChI=1S/C31H41N3Si2/c1-35(2,3)34(36(4,5)6)24-16-23-30-25-33(26-32-30)31(27-17-10-7-11-18-27,28-19-12-8-13-20-28)29-21-14-9-15-22-29/h7-15,17-22,25-26H,16,23-24H2,1-6H3
InChIKey MLMXRWFHGBOACR-UHFFFAOYSA-N
Mol Weight 511.9 g/mol
Molecular Formula C31H41N3Si2
Exact Mass 511.283901 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KjuGGmcDt5B
Name 3-(1-Trityl-1H-imidazol-4-yl)propan-1-amine, 2tms
Comments Computed using HOSE algorithm
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Exact Mass 511.283901402 u
Formula C31H41N3Si2
InChI InChI=1S/C31H41N3Si2/c1-35(2,3)34(36(4,5)6)24-16-23-30-25-33(26-32-30)31(27-17-10-7-11-18-27,28-19-12-8-13-20-28)29-21-14-9-15-22-29/h7-15,17-22,25-26H,16,23-24H2,1-6H3
InChIKey MLMXRWFHGBOACR-UHFFFAOYSA-N
Molecular Weight 511.860 g/mol
SMILES C(N1C=C(CCCN([Si](C)(C)C)[Si](C)(C)C)N=C1)(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1