| SpectraBase Spectrum ID |
ERN6CwsWRUQ |
| Name |
3,5-Dimethyl-7,8-dihydroxy-3,4-dihydro-isobenzofuran-1-one |
| Alternate Name(s) |
7-Hydroxy-5-methyl-mellein
(3R)-7,8-dihydroxy-3,5-dimethyl-3,4-dihydro-1H-2-benzopyran-1-one
(3R)-7,8-dihydroxy-3,5-dimethyl-3,4-dihydroisochromen-1-one
(3R)-3,5-dimethyl-7,8-bis(oxidanyl)-3,4-dihydroisochromen-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H12O4 |
| InChI |
InChI=1S/C11H12O4/c1-5-3-8(12)10(13)9-7(5)4-6(2)15-11(9)14/h3,6,12-13H,4H2,1-2H3/t6-/m1/s1 |
| InChIKey |
XITCGWRCIXZQJW-ZCFIWIBFSA-N |
| Molecular Weight |
208.213 g/mol |
| SMILES |
Oc1c(cc(c2C[C@](OC(c12)=O)(C)[H])C)O |
| SPLASH |
splash10-0bt9-0980000000-bae861fc8ca59713c3e3 |
| Source of Spectrum |
G4-71-273-2 |
| Wiley ID |
1695245 |
