| SpectraBase Spectrum ID |
Ae19rkyZNXQ |
| Name |
(2E,8E)-9-(1,3-benzodioxol-5-yl)nona-2,8-dienoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18O4 |
| InChI |
InChI=1S/C16H18O4/c17-16(18)8-6-4-2-1-3-5-7-13-9-10-14-15(11-13)20-12-19-14/h5-11H,1-4,12H2,(H,17,18)/b7-5+,8-6+ |
| InChIKey |
BTNNQKBYXMSXJQ-KQQUZDAGSA-N |
| Molecular Weight |
274.316 g/mol |
| SMILES |
OC(\C=C\CCCC\C=C\c1cc2c(OCO2)cc1)=O |
| SPLASH |
splash10-0089-0950000000-cc78a2bd6dd8e385b247 |
| Source of Spectrum |
E1-45-693-0 |
| Wiley ID |
1553841 |
