| SpectraBase Spectrum ID |
CQWXQZQqZHH |
| Name |
rac-3-((3aS,5R,7S,7aS)-1-isopropyl-3,3,5,7-tetramethyloctahydrobenzo[c]isoxazol-5-yl)-4-Toluonitrile |
| Appearance |
Pale yellow oil |
| 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-RAWXMELESA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Molecular Weight |
340.511 g/mol |
| SMILES |
[C@@]12([H])[C@@](N(OC2(C)C)C(C)C)([C@](C[C@](C)(C1)c1c(ccc(c1)C#N)C)(C)[H])[H] |
| SPLASH |
splash10-0fb9-1911000000-8058d4a87ab7e6b0e79d |
| Source of Spectrum |
CN114761385A |
| Wiley ID |
1884597 |
![rac-3-((3aS,5R,7S,7aS)-1-isopropyl-3,3,5,7-tetramethyloctahydrobenzo[c]isoxazol-5-yl)-4-Toluonitrile](/api/spectrum/CQWXQZQqZHH/structure.png?h=300&w=458 "rac-3-((3aS,5R,7S,7aS)-1-isopropyl-3,3,5,7-tetramethyloctahydrobenzo[c]isoxazol-5-yl)-4-Toluonitrile")
