| SpectraBase Spectrum ID |
4BD2V1ndQST |
| Name |
(3aS*,4S*,7aS*)-4,7a-Dimethyl-4-ethylhexahydrobenzofuran-2(3H)-one |
| Appearance |
White needles |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H18O2 |
| InChI |
InChI=1S/C11H18O2/c1-3-11(2)6-4-5-9-8(11)7-10(12)13-9/h8-9H,3-7H2,1-2H3/t8-,9+,11+/m1/s1 |
| InChIKey |
ARSPAFXUYYYNPJ-YWVKMMECSA-N |
| Instrument Name |
Agilent 7890A-5975C or Agilent 6890-5973N |
| Ionization Type |
EI |
| Molecular Weight |
182.263 g/mol |
| SMILES |
[C@]1(CCC[C@]2([C@]1(CC(O2)=O)[H])[H])(CC)C |
| SPLASH |
splash10-053r-8900000000-110b4b7c3c98a4e6630a |
| Source of Spectrum |
WO2017184870A1 |
| Wiley ID |
1855494 |
