| SpectraBase Spectrum ID |
CrfJazGDt3n |
| Name |
Benzenebutanoic acid, 3,4-dicyano-2,5-dihydroxy- |
| Alternate Name(s) |
4-(3,4-Dicyano-2',5'-dihydroxyphenyl)butanoic acid
4-(3,4-dicyano-2,5-dihydroxyphenyl)butanoic acid |
| CAS Registry Number |
83575-15-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H10N2O4 |
| InChI |
InChI=1S/C12H10N2O4/c13-5-8-9(6-14)12(18)7(4-10(8)15)2-1-3-11(16)17/h4,15,18H,1-3H2,(H,16,17) |
| InChIKey |
XTEBBJNQYRVLRN-UHFFFAOYSA-N |
| Molecular Weight |
246.222 g/mol |
| SMILES |
Oc1c(c(c(c(c1)CCCC(=O)O)O)C#N)C#N |
| SPLASH |
splash10-004r-1790000000-5bc941a7ad8d6dbcff99 |
| Source of Spectrum |
F-38-1475-0 |
| Wiley ID |
1248620 |
