| SpectraBase Spectrum ID |
9VcRmX6Zyb7 |
| Name |
2-Benzoylamido-3-(3,4-methylenedioxyphenyl)propenoic acid |
| Alternate Name(s) |
(Z)-2-benzamido-3-(1,3-benzodioxol-5-yl)-2-propenoic acid
(Z)-2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H13NO5 |
| InChI |
InChI=1S/C17H13NO5/c19-16(12-4-2-1-3-5-12)18-13(17(20)21)8-11-6-7-14-15(9-11)23-10-22-14/h1-9H,10H2,(H,18,19)(H,20,21)/b13-8- |
| InChIKey |
XXTGKIRVFYJOKQ-JYRVWZFOSA-N |
| Molecular Weight |
311.293 g/mol |
| SMILES |
N(\C(C(=O)O)=C/c1cc2OCOc2cc1)C(=O)c1ccccc1 |
| SPLASH |
splash10-0a4i-0900000000-9aa92f777146ee540f81 |
| Source of Spectrum |
SO-0-795-4 |
| Wiley ID |
1543438 |
