| SpectraBase Spectrum ID |
Biqcq77T3AA |
| Name |
3-Cyclohexene-1-carboxylic acid, 3-(2,2-dimethylpropoxy)-4,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, [1S-[1.alpha.,2.alpha.(S*),3.alpha.,4.alpha.]]- |
| CAS Registry Number |
106618-24-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H36O3 |
| InChI |
InChI=1S/C22H36O3/c1-20(2,3)14-24-18-17(16-12-13-22(18,6)21(16,4)5)25-19(23)15-10-8-7-9-11-15/h7-8,15-18H,9-14H2,1-6H3/t15?,16-,17-,18-,22+/m1/s1 |
| InChIKey |
DGSYZBRCKVOTLN-ZLEGMDOLSA-N |
| Molecular Weight |
348.527 g/mol |
| SMILES |
[C@]12(C([C@]([H])(CC2)[C@]([C@]1(OCC(C)(C)C)[H])(OC(=O)C1CC=CCC1)[H])(C)C)C |
| SPLASH |
splash10-00e9-5930000000-bab65ec4c42cd1b1a581 |
| Source of Spectrum |
H-68-2111-29 |
| Synonyms |
(1S,2R,3S)-3-(2,2-Dimethylpropoxy)-4,7,7-trimethylbicyclo[2.2.1]hept-2-yl (1R)-cyclohex-3-ene-1-carboxylate
(1S,2R,3S)-4,7,7-trimethyl-3-(neopentyloxy)bicyclo[2.2.1]hept-2-yl 3-cyclohexene-1-carboxylate |
| Wiley ID |
1341003 |
![3-Cyclohexene-1-carboxylic acid, 3-(2,2-dimethylpropoxy)-4,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, [1S-[1.alpha.,2.alpha.(S*),3.alpha.,4.alpha.]]-](/api/spectrum/Biqcq77T3AA/structure.png?h=300&w=458 "3-Cyclohexene-1-carboxylic acid, 3-(2,2-dimethylpropoxy)-4,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, [1S-[1.alpha.,2.alpha.(S*),3.alpha.,4.alpha.]]-")
