| SpectraBase Spectrum ID |
Fk7zbYh4qG0 |
| Name |
Isobutyric acid (9R)-8,8-dimethyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-2-one-9-yl ester |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20O5 |
| InChI |
InChI=1S/C18H20O5/c1-10(2)17(20)21-14-9-12-13(23-18(14,3)4)7-5-11-6-8-15(19)22-16(11)12/h5-8,10,14H,9H2,1-4H3/t14-/m1/s1 |
| InChIKey |
PKHNHXIOSSYBJU-CQSZACIVSA-N |
| Instrument Name |
JEOL JMS-AX505HA |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1021/np010448t |
| Molecular Weight |
316.353 g/mol |
| Optical Rotation |
[a]D20 = +20 (c = 1, CHCl3) |
| SMILES |
c12OC([C@@](Cc2c2c(cc1)C=CC(O2)=O)(OC(=O)C(C)C)[H])(C)C |
| SPLASH |
splash10-03di-4390000000-9a808350366a727338c0 |
| Source of Spectrum |
G4-65-SM20-10 |
| Wiley ID |
1883674 |
![Isobutyric acid (9R)-8,8-dimethyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-2-one-9-yl ester](/api/spectrum/Fk7zbYh4qG0/structure.png?h=300&w=458 "Isobutyric acid (9R)-8,8-dimethyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-2-one-9-yl ester")
