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(4S,4ar)-4-(Hydroxymethyl)-3,4A,8,8-tetramethyl-5,6,7,8A-tetrahydro-4H-naphthalen-1-one, tms derivative
SpectraBase Compound ID JxYICheG4wp
InChI InChI=1S/C18H32O2Si/c1-13-11-15(19)16-17(2,3)9-8-10-18(16,4)14(13)12-20-21(5,6)7/h11,14,16H,8-10,12H2,1-7H3/t14-,16?,18+/m0/s1
InChIKey PJODUKMDPFAVAM-GVVCSIHDSA-N
Mol Weight 308.5 g/mol
Molecular Formula C18H32O2Si
Exact Mass 308.217157 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I9yiPLZuIV6
Name (4S,4ar)-4-(Hydroxymethyl)-3,4A,8,8-tetramethyl-5,6,7,8A-tetrahydro-4H-naphthalen-1-one, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 308.217156803 u
Formula C18H32O2Si
InChI InChI=1S/C18H32O2Si/c1-13-11-15(19)16-17(2,3)9-8-10-18(16,4)14(13)12-20-21(5,6)7/h11,14,16H,8-10,12H2,1-7H3/t14-,16?,18+/m0/s1
InChIKey PJODUKMDPFAVAM-GVVCSIHDSA-N
Molecular Weight 308.537 g/mol
SMILES C1(C=C([C@@]([C@@]2(C1C(CCC2)(C)C)C)(CO[Si](C)(C)C)[H])C)=O