| SpectraBase Spectrum ID |
5V6hOAyE05H |
| Name |
2'-[(1R,2S,5R)-2-(tert-Butyl)-5-methylcyclohexyloxycarbonyl] (2'R/S)-3',3'-dimethylbutanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H32O4 |
| InChI |
InChI=1S/C18H32O4/c1-11-8-9-12(17(2,3)4)13(10-11)22-16(21)14(15(19)20)18(5,6)7/h11-14H,8-10H2,1-7H3,(H,19,20)/t11-,12-,13-,14?/m1/s1 |
| InChIKey |
CEAKQFZZOZNVTO-ZHZAVPAVSA-N |
| Instrument Name |
Finnigan MAT, Varian Saturn II |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.13.5 |
| Molecular Weight |
312.450 g/mol |
| Reported Formula |
C18H32O4 |
| SMILES |
OC(C(C(O[C@@]1(C[C@@](CC[C@]1(C(C)(C)C)[H])(C)[H])[H])=O)C(C)(C)C)=O |
| SPLASH |
splash10-0a6r-1900000000-9371bac0c6e23c4db2c9 |
| Source of Spectrum |
BJO-13-SM12-15a/b |
| Wiley ID |
1848315 |
![2'-[(1R,2S,5R)-2-(tert-Butyl)-5-methylcyclohexyloxycarbonyl] (2'R/S)-3',3'-dimethylbutanoic acid](/api/spectrum/5V6hOAyE05H/structure.png?h=300&w=458 "2'-[(1R,2S,5R)-2-(tert-Butyl)-5-methylcyclohexyloxycarbonyl] (2'R/S)-3',3'-dimethylbutanoic acid")
