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(S)-N-(3-Deuterium-3-octyl)-p,p-diphenylphosphinamide
SpectraBase Compound ID 8u4ft56jyLP
InChI InChI=1S/C20H28NOP/c1-3-5-8-13-18(4-2)21-23(22,19-14-9-6-10-15-19)20-16-11-7-12-17-20/h6-7,9-12,14-18H,3-5,8,13H2,1-2H3,(H,21,22)/t18-/m0/s1/i18D
InChIKey GYZWAQISZMZBCI-DGQQIMSPSA-N
Mol Weight 330.43 g/mol
Molecular Formula C20H272HNOP
Exact Mass 330.197128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 13ObxdaRfhy
Name (S)-N-(3-Deuterium-3-octyl)-p,p-diphenylphosphinamide
Comments Computed using HOSE algorithm
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Exact Mass 330.197128269 u
Formula C20H27[2H]NOP
InChI InChI=1S/C20H28NOP/c1-3-5-8-13-18(4-2)21-23(22,19-14-9-6-10-15-19)20-16-11-7-12-17-20/h6-7,9-12,14-18H,3-5,8,13H2,1-2H3,(H,21,22)/t18-/m0/s1/i18D
InChIKey GYZWAQISZMZBCI-DGQQIMSPSA-N
Molecular Weight 330.430 g/mol
Nominal Mass 330 u
SMILES C1(P(=O)(C2=CC=CC=C2)N[C@@](CC)(CCCCC)[2H])=CC=CC=C1