| SpectraBase Spectrum ID |
ETG3nQhiM0i |
| Name |
1(2H)-Pentalenone, 2-(3-butynyl)hexahydro-5,5-dimethyl-, (2.alpha.,3a.beta.,6a.beta.)-(.+-.)- |
| CAS Registry Number |
115650-10-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20O |
| InChI |
InChI=1S/C14H20O/c1-4-5-6-10-7-11-8-14(2,3)9-12(11)13(10)15/h1,10-12H,5-9H2,2-3H3/t10-,11-,12+/m1/s1 |
| InChIKey |
XIKAPDRKCSFOGQ-UTUOFQBUSA-N |
| Molecular Weight |
204.313 g/mol |
| SMILES |
[C@@]12(C([C@](CCC#C)(C[C@@]2(CC(C1)(C)C)[H])[H])=O)[H] |
| SPLASH |
splash10-0f8d-9100000000-cdad3e2d3363acd8aef9 |
| Source of Spectrum |
F-46-1868-15 |
| Synonyms |
(2R,3aR,6aS)-2-(3-butynyl)-5,5-dimethylhexahydro-1(2H)-pentalenone
3-(3-Butynyl)-7,7-dimethylbicyclo[3.3.0]octan-2-one |
| Wiley ID |
1202341 |
