| SpectraBase Spectrum ID |
9Ab5YogGXnX |
| Name |
(3R)-5-methylmellein |
| Alternate Name(s) |
(R) 3,5-Dimethyl-8-hydroxy-3,4-dihydro-isocoumarin
(3R)-8-hydroxy-3,5-dimethyl-3,4-dihydro-1H-2-benzopyran-1-one
(3R)-8-hydroxy-3,5-dimethyl-3,4-dihydroisochromen-1-one
(3R)-3,5-dimethyl-8-oxidanyl-3,4-dihydroisochromen-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H12O3 |
| InChI |
InChI=1S/C11H12O3/c1-6-3-4-9(12)10-8(6)5-7(2)14-11(10)13/h3-4,7,12H,5H2,1-2H3/t7-/m1/s1 |
| InChIKey |
YETSBBYQOFXYGV-SSDOTTSWSA-N |
| Molecular Weight |
192.214 g/mol |
| SMILES |
Oc1c2C(O[C@@](Cc2c(C)cc1)(C)[H])=O |
| SPLASH |
splash10-0006-0900000000-53a48f20ddc441ca0cf6 |
| Source of Spectrum |
G4-71-1397-7 |
| Wiley ID |
1695103 |
