α-Cyano-4-hydroxycinnamic acid
1468
Reference
α-Cyano-4-hydroxycinnamic acid Structure
Systematic / IUPAC Name: (2E)-2-Cyano-3-(4-hydroxyphenyl)acrylic acid
ID: Reference1468
Other Names:
(2E)-2-Cyano-3-(4-hydroxyphenyl)prop-2-enoic acid;
2-Propenoic acid, 2-cyano-3-(4-hydroxyphenyl)-
Formula: C10H7NO3
Spectral Data
α-Cyano-4-hydroxycinnamic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 2 |
| No. of Spectra | 144 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 12/3/2014 11:10:37 AM |
Identificators
| InChI | InChI=1S/C10H7NO3/c11-6-8(10(13)14)5-7-1-3-9(12)4-2-7/h1-5,12H,(H,13,14)/b8-5+ |
| InChI Key | AFVLVVWMAFSXCK-VMPITWQZSA-N |
| Canonical SMILES | C1=CC(=CC=C1C=C(C#N)C(=O)O)O |
| CAS | 28166418 |
| Splash | |
| Other Names |
(2E)-2-Cyano-3-(4-hydroxyphenyl)prop-2-enoic acid; 2-Propenoic acid, 2-cyano-3-(4-hydroxyphenyl)- |
In Other Databases
| PubChem | 5328791 |
| ChEBI | CHEBI:64340 |
| ChemSpider | 7969870 |
| ChEMBL | CHEMBL76602 |
| Wikipedia | Alpha-Cyano-4-hydroxycinnamic acid |