| SpectraBase Spectrum ID |
FPQdUG4JIA1 |
| Name |
(E)-3-Isovalidenephthalide |
| Alternate Name(s) |
(3E)-2-methyl-but-3-ylidene-1-isobenzofuranone
(3E)-2-methyl-but-3-ylideneisobenzofuran-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14O2 |
| InChI |
InChI=1S/C13H14O2/c1-9(2)7-8-12-10-5-3-4-6-11(10)13(14)15-12/h3-6,8-9H,7H2,1-2H3/b12-8+ |
| InChIKey |
LLCYNDRFWDIIQS-XYOKQWHBSA-N |
| Molecular Weight |
202.253 g/mol |
| SMILES |
C1(O\C(=C\CC(C)C)c2c1cccc2)=O |
| SPLASH |
splash10-0pb9-0910000000-4651a68e3224d286b389 |
| Source of Spectrum |
H1-36-559-E-3ab |
| Wiley ID |
755067 |
