| SpectraBase Spectrum ID |
FEzcJ3abx8K |
| Name |
(Z)-2-acetamido-3-(1,3-benzodioxol-5-yl)-2-propenoic acid |
| Alternate Name(s) |
(Z)-2-acetamido-3-(1,3-benzodioxol-5-yl)acrylic acid
(Z)-2-acetamido-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 |
C12H11NO5 |
| InChI |
InChI=1S/C12H11NO5/c1-7(14)13-9(12(15)16)4-8-2-3-10-11(5-8)18-6-17-10/h2-5H,6H2,1H3,(H,13,14)(H,15,16)/b9-4- |
| InChIKey |
QTNHDDAPMUJZSZ-WTKPLQERSA-N |
| Molecular Weight |
249.222 g/mol |
| SMILES |
OC(\C(=C\c1cc2OCOc2cc1)NC(=O)C)=O |
| SPLASH |
splash10-0a4i-0090000000-1eb8f95a508121c09996 |
| Source of Spectrum |
SO-0-795-4 |
| Wiley ID |
1543439 |
