| SpectraBase Spectrum ID |
CRbmotIzId2 |
| Name |
2-Propyn-1-one, 1-(2,3-dimethylbicyclo[2.2.1]hept-2-yl)-, (2-exo,3-endo)-(.+-.)- |
| Alternate Name(s) |
1-[(1R,2S,3S,4S)-2,3-dimethylbicyclo[2.2.1]hept-2-yl]-2-propyn-1-one
[(1R*,2S*,3S*,4S*)-2,3-dimethylbicyclo[2.2.1]-2-heptyl]-ketone |
| CAS Registry Number |
86510-05-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16O |
| InChI |
InChI=1S/C12H16O/c1-4-11(13)12(3)8(2)9-5-6-10(12)7-9/h1,8-10H,5-7H2,2-3H3/t8-,9-,10+,12+/m0/s1 |
| InChIKey |
OZPAAPKLLBVRGL-UXCLJVHYSA-N |
| Molecular Weight |
176.259 g/mol |
| SMILES |
[C@]1([C@]2(C[C@@]([C@@]1(C)[H])(CC2)[H])[H])(C(C#C)=O)C |
| SPLASH |
splash10-00e9-9700000000-35fb2b33450ed4c2926c |
| Source of Spectrum |
H-66-630-0 |
| Wiley ID |
1172703 |
![2-Propyn-1-one, 1-(2,3-dimethylbicyclo[2.2.1]hept-2-yl)-, (2-exo,3-endo)-(.+-.)-](/api/spectrum/CRbmotIzId2/structure.png?h=300&w=458 "2-Propyn-1-one, 1-(2,3-dimethylbicyclo[2.2.1]hept-2-yl)-, (2-exo,3-endo)-(.+-.)-")
