| SpectraBase Spectrum ID |
9v48lpx2Hlg |
| Name |
(1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl (2'R/S)-2'-(tert-butyl)-4',4'-dimethylpentanoate |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H40O2 |
| InChI |
InChI=1S/C21H40O2/c1-14(2)16-11-10-15(3)12-18(16)23-19(22)17(21(7,8)9)13-20(4,5)6/h14-18H,10-13H2,1-9H3/t15-,16+,17?,18-/m1/s1 |
| InChIKey |
PQNGTPVWCVFIMP-UJJTZGENSA-N |
| Instrument Name |
Finnigan MAT, Varian Saturn II |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.13.5 |
| Molecular Weight |
324.549 g/mol |
| SMILES |
C1[C@](C[C@]([C@@](C1)(C(C)C)[H])(OC(C(CC(C)(C)C)C(C)(C)C)=O)[H])(C)[H] |
| SPLASH |
splash10-000i-7900000000-f78f44f66470a9d99101 |
| Sample Comments |
10% de |
| Source of Spectrum |
BJO-13-SM15-22a/b |
| Wiley ID |
1848317 |
