| SpectraBase Spectrum ID |
8ehT4mPelJU |
| Name |
4a,9a-trans-9a-Hydroxy-4a-methyl-3,4,4a,9a-tetrahydro-2H-xanthene-1,9-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H14O4 |
| InChI |
InChI=1S/C14H14O4/c1-13-8-4-7-11(15)14(13,17)12(16)9-5-2-3-6-10(9)18-13/h2-3,5-6,17H,4,7-8H2,1H3/t13-,14-/m0/s1 |
| InChIKey |
RHDXWNOXOJCFRA-KBPBESRZSA-N |
| Molecular Weight |
246.262 g/mol |
| SMILES |
O[C@]12C(c3ccccc3O[C@]2(CCCC1=O)C)=O |
| SPLASH |
splash10-00di-0930000000-add407e3ce8fc83f2f49 |
| Source of Spectrum |
QE-12-3653-22 |
| Synonyms |
(4aS,9aS)-9a-hydroxy-4a-methyl-3,4,4a,9a-tetrahydro-1H-xanthene-1,9(2H)-dione |
| Wiley ID |
1586926 |
