For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4.beta.-Propionyl-3.alpha.-p-tolyl-6-azabicyclo[3.2.2]nonane
SpectraBase Compound ID GjroykXQy1z
InChI InChI=1S/C18H25NO/c1-3-17(20)18-15(14-7-4-12(2)5-8-14)10-13-6-9-16(18)19-11-13/h4-5,7-8,13,15-16,18-19H,3,6,9-11H2,1-2H3/t13-,15-,16+,18-/m0/s1
InChIKey XDLOBQBVSNOHRE-SCNOPHJPSA-N
Mol Weight 271.4 g/mol
Molecular Formula C18H25NO
Exact Mass 271.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1sQwOq9cNmb
Name 4.beta.-Propionyl-3.alpha.-p-tolyl-6-azabicyclo[3.2.2]nonane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO
InChI InChI=1S/C18H25NO/c1-3-17(20)18-15(14-7-4-12(2)5-8-14)10-13-6-9-16(18)19-11-13/h4-5,7-8,13,15-16,18-19H,3,6,9-11H2,1-2H3/t13-,15-,16+,18-/m0/s1
InChIKey XDLOBQBVSNOHRE-SCNOPHJPSA-N
Molecular Weight 271.404 g/mol
SMILES N1C[C@@]2(C[C@]([C@@]([C@]1(CC2)[H])(C(=O)CC)[H])(c1ccc(cc1)C)[H])[H]
SPLASH splash10-03di-0090000000-cd37ce8b80135c85f772
Source of Spectrum J-66-7901-12
Synonyms 1-[3-(4-methylphenyl)-6-azabicyclo[3.2.2]non-4-yl]-1-propanone 1-[3-(4-methylphenyl)-6-azabicyclo[3.2.2]nonan-4-yl]-1-propanone 1-[3-(4-methylphenyl)-6-azabicyclo[3.2.2]nonan-4-yl]propan-1-one
Wiley ID 1568465