| SpectraBase Spectrum ID |
6dXDQs6eHua |
| Name |
2-benzamido-3-(3,4-dihydroxyphenyl)propanoic acid |
| Alternate Name(s) |
2-benzamido-3-(3,4-dihydroxyphenyl)propionic acid
2-benzamido-3-[3,4-bis(oxidanyl)phenyl]propanoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H15NO5 |
| InChI |
InChI=1S/C16H15NO5/c18-13-7-6-10(9-14(13)19)8-12(16(21)22)17-15(20)11-4-2-1-3-5-11/h1-7,9,12,18-19H,8H2,(H,17,20)(H,21,22) |
| InChIKey |
WGTPJOPXQRPTDE-UHFFFAOYSA-N |
| Molecular Weight |
301.298 g/mol |
| SMILES |
Oc1c(cc(CC(C(=O)O)NC(c2ccccc2)=O)cc1)O |
| SPLASH |
splash10-000i-0901000000-22f82b693e893614a7b9 |
| Source of Spectrum |
SO-0-796-7 |
| Wiley ID |
1543563 |
