| SpectraBase Spectrum ID |
FCWMPlSiVgK |
| Name |
(2E,6E)-7-(3',4'-Methylenedioxyphenyl)-2,6-heptadienoic acid |
| Alternate Name(s) |
(2E,6E)-7-(1,3-benzodioxol-5-yl)-2,6-heptadienoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H14O4 |
| InChI |
InChI=1S/C14H14O4/c15-14(16)6-4-2-1-3-5-11-7-8-12-13(9-11)18-10-17-12/h3-9H,1-2,10H2,(H,15,16)/b5-3+,6-4+ |
| InChIKey |
CWJPYBUIYZXCHF-GGWOSOGESA-N |
| Molecular Weight |
246.262 g/mol |
| SMILES |
OC(\C=C\CC\C=C\c1cc2c(OCO2)cc1)=O |
| SPLASH |
splash10-001i-0930000000-1ee880db65c49ad42fb3 |
| Source of Spectrum |
E1-45-693-0 |
| Wiley ID |
1553842 |
