| SpectraBase Spectrum ID |
2x8IOwYzxxP |
| Name |
1H-2-Benzopyran-1-one-4-d, 6,8-dihydroxy-7-methyl-3-(methyl-D3)- |
| Alternate Name(s) |
[4-(2)h,9-(2)H(3)]-6,8-dihydroxy-3,7-dimethylisocoumarin |
| CAS Registry Number |
102725-97-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H6D4O4 |
| InChI |
InChI=1S/C11H10O4/c1-5-3-7-4-8(12)6(2)10(13)9(7)11(14)15-5/h3-4,12-13H,1-2H3/i1D3,3D |
| InChIKey |
VWQBFGBCLXWGQH-VYMTUXDUSA-N |
| Molecular Weight |
210.221 g/mol |
| SMILES |
Oc1cc2C(=C(OC(c2c(c1C)O)=O)C([2D])([2D])[2D])[2D] |
| SPLASH |
splash10-03di-0490000000-0b31725b4c6082a6e2e1 |
| Source of Spectrum |
KC-1988-753-20 |
| Wiley ID |
1204198 |
