SpectraBase Spectrum ID |
FSl1NgjypsE |
Name |
rac-4-((3aR,5R,7S,7aR)-1,3,3,5,7-pentamethyloctahydrobenzo[c]isoxazol-5-yl)benzonitrile |
Appearance |
Pale yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H26N2O |
InChI |
InChI=1S/C19H26N2O/c1-13-10-19(4,15-8-6-14(12-20)7-9-15)11-16-17(13)21(5)22-18(16,2)3/h6-9,13,16-17H,10-11H2,1-5H3/t13-,16+,17+,19+/m0/s1 |
InChIKey |
YNOMTWMUNXTHKO-CNDLSXRNSA-N |
Instrument Name |
GCMS |
Ionization Type |
EI |
Molecular Weight |
298.430 g/mol |
SMILES |
C1(ON([C@]2([C@]1(C[C@@](C[C@@]2(C)[H])(c1ccc(cc1)C#N)C)[H])[H])C)(C)C |
SPLASH |
splash10-016s-7920000000-bde568cde45732b7121b |
Source of Spectrum |
CN114761385A |
Wiley ID |
1884375 |