| SpectraBase Spectrum ID |
1sfA6ChhAvT |
| Name |
(1R,2S,5R)-5-Methyl-2-(2-phenypropane-2-yl)cyclohexyl 3-oxopentanoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30O3 |
| InChI |
InChI=1S/C21H30O3/c1-5-17(22)14-20(23)24-19-13-15(2)11-12-18(19)21(3,4)16-9-7-6-8-10-16/h6-10,15,18-19H,5,11-14H2,1-4H3/t15-,18-,19-/m1/s1 |
| InChIKey |
DNTLDOGJFFWCTQ-ATZDWAIDSA-N |
| Molecular Weight |
330.468 g/mol |
| SMILES |
[C@]1([C@](OC(CC(=O)CC)=O)(C[C@@](CC1)(C)[H])[H])(C(c1ccccc1)(C)C)[H] |
| SPLASH |
splash10-001i-0009000000-189edda0c69f47d2eabc |
| Source of Spectrum |
F-67-930-3c |
| Wiley ID |
1685597 |
