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(3S,8aR)-3-benzyl-8a-ethyltetrahydro-2H-oxazolo[3,2-a]pyridin-5(3H)-one
SpectraBase Compound ID ALlf7pEEq1r
InChI InChI=1S/C16H21NO2/c1-2-16-10-6-9-15(18)17(16)14(12-19-16)11-13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12H2,1H3/t14-,16+/m0/s1
InChIKey PUCUNKSUPMPQGZ-GOEBONIOSA-N
Mol Weight 259.35 g/mol
Molecular Formula C16H21NO2
Exact Mass 259.157229 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EvGl7RvGuq3
Name (3S,8ar)-3-Benzyl-8A-ethyltetrahydro-2H-oxazolo[3,2-A]pyridin-5(3H)-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 259.157228918 u
Formula C16H21NO2
InChI InChI=1S/C16H21NO2/c1-2-16-10-6-9-15(18)17(16)14(12-19-16)11-13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12H2,1H3/t14-,16+/m0/s1
InChIKey PUCUNKSUPMPQGZ-GOEBONIOSA-N
Molecular Weight 259.349 g/mol
SMILES C1(N2[C@@](CC3=CC=CC=C3)(CO[C@@]2(CCC1)CC)[H])=O