| SpectraBase Spectrum ID |
I6joaa43hLj |
| Name |
(3Z)-3-(2,2-dimethylpropylidene)-1-isobenzofuranone |
| Alternate Name(s) |
(3Z)-3-(2,2-dimethylpropylidene)-2-benzofuran-1-one
(3Z)-3-(2,2-dimethylpropylidene)isobenzofuran-1-one
(3Z)-3-neopentylidenephthalide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14O2 |
| InChI |
InChI=1S/C13H14O2/c1-13(2,3)8-11-9-6-4-5-7-10(9)12(14)15-11/h4-8H,1-3H3/b11-8- |
| InChIKey |
XUNJJFKLXOUARV-FLIBITNWSA-N |
| Molecular Weight |
202.253 g/mol |
| SMILES |
C1(O\C(c2c1cccc2)=C\C(C)(C)C)=O |
| SPLASH |
splash10-000i-0910000000-eafc7437485909f991d4 |
| Source of Spectrum |
H1-41-2595-2 |
| Wiley ID |
757368 |
