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 |