| SpectraBase Spectrum ID |
7U30nocewF9 |
| Name |
(E)-3-[4,5-(Methylenerdioxy)-2-methylphenyl]-2-propenoic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
206.057908798 u |
| Formula |
C11H10O4 |
| InChI |
InChI=1S/C11H10O4/c1-7-4-9-10(15-6-14-9)5-8(7)2-3-11(12)13/h2-5H,6H2,1H3,(H,12,13)/b3-2+ |
| InChIKey |
RXKAEEZNMRAZFB-NSCUHMNNSA-N |
| Molecular Weight |
206.197 g/mol |
| SMILES |
C1(\C=C\C(=O)O)=CC=2OCOC2C=C1C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908589 |
![(E)-3-[4,5-(Methylenerdioxy)-2-methylphenyl]-2-propenoic acid](/api/spectrum/7U30nocewF9/structure.png?h=300&w=458 "(E)-3-[4,5-(Methylenerdioxy)-2-methylphenyl]-2-propenoic acid")
