| SpectraBase Spectrum ID |
Ac2CuJdxjFg |
| Name |
rac-3-((3aR,5R,7S,7aR)-1-isopropyl-3,3,5,7-tetramethyloctahydrobenzo[c]isoxazol-5-yl)-4-methylbenzonitrile |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H32N2O |
| InChI |
InChI=1S/C22H32N2O/c1-14(2)24-20-16(4)11-22(7,12-19(20)21(5,6)25-24)18-10-17(13-23)9-8-15(18)3/h8-10,14,16,19-20H,11-12H2,1-7H3/t16-,19+,20+,22+/m0/s1 |
| InChIKey |
ASDZJWXBEBQEQH-AQZFEABFSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Molecular Weight |
340.511 g/mol |
| SMILES |
C(N1OC([C@]2([C@]1([C@](C[C@](C2)(c1cc(ccc1C)C#N)C)(C)[H])[H])[H])(C)C)(C)C |
| SPLASH |
splash10-0fb9-0905000000-01d49022fa6c8a3770cd |
| Source of Spectrum |
CN114761385A |
| Wiley ID |
1884596 |
![rac-3-((3aR,5R,7S,7aR)-1-isopropyl-3,3,5,7-tetramethyloctahydrobenzo[c]isoxazol-5-yl)-4-methylbenzonitrile](/api/spectrum/Ac2CuJdxjFg/structure.png?h=300&w=458 "rac-3-((3aR,5R,7S,7aR)-1-isopropyl-3,3,5,7-tetramethyloctahydrobenzo[c]isoxazol-5-yl)-4-methylbenzonitrile")
