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Lysergic acid tbdms derivative

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Lysergic acid tbdms derivative
SpectraBase Compound ID KzrQSmZq0yF
InChI InChI=1S/C22H30N2O2Si/c1-22(2,3)27(5,6)26-21(25)15-10-17-16-8-7-9-18-20(16)14(12-23-18)11-19(17)24(4)13-15/h7-10,12,15,19,23H,11,13H2,1-6H3
InChIKey IEPITDMEPPUJBV-UHFFFAOYSA-N
Mol Weight 382.58 g/mol
Molecular Formula C22H30N2O2Si
Exact Mass 382.207655 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DHUbaX4mtRT
Name Lysergic acid tbdms derivative
Comments Computed using HOSE algorithm
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Exact Mass 382.207654747 u
Formula C22H30N2O2Si
InChI InChI=1S/C22H30N2O2Si/c1-22(2,3)27(5,6)26-21(25)15-10-17-16-8-7-9-18-20(16)14(12-23-18)11-19(17)24(4)13-15/h7-10,12,15,19,23H,11,13H2,1-6H3
InChIKey IEPITDMEPPUJBV-UHFFFAOYSA-N
Molecular Weight 382.579 g/mol
SMILES N1C=C2C[C@]3(N(C[C@@](C=C3C=3C=CC=C1C23)(C(O[Si](C)(C)C(C)(C)C)=O)[H])C)[H]