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Lysergic acid tms derivative

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

Lysergic acid tms derivative
SpectraBase Compound ID hQXxWX37hv
InChI InChI=1S/C19H24N2O2Si/c1-21-11-13(19(22)23-24(2,3)4)8-15-14-6-5-7-16-18(14)12(10-20-16)9-17(15)21/h5-8,10,13,17,20H,9,11H2,1-4H3/t13-,17-/m1/s1
InChIKey IBNPGZQFRNZDQI-CXAGYDPISA-N
Mol Weight 340.5 g/mol
Molecular Formula C19H24N2O2Si
Exact Mass 340.160705 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CtMudm9jbVG
Name Lysergic acid tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 340.160704554 u
Formula C19H24N2O2Si
InChI InChI=1S/C19H24N2O2Si/c1-21-11-13(19(22)23-24(2,3)4)8-15-14-6-5-7-16-18(14)12(10-20-16)9-17(15)21/h5-8,10,13,17,20H,9,11H2,1-4H3/t13-,17-/m1/s1
InChIKey IBNPGZQFRNZDQI-CXAGYDPISA-N
Molecular Weight 340.498 g/mol
SMILES N1C=C2C[C@]3(N(C[C@@](C=C3C=3C=CC=C1C23)(C(O[Si](C)(C)C)=O)[H])C)[H]