| SpectraBase Spectrum ID |
AvsoDytyk9G |
| Name |
2-(6-Methyl-3,4-dioxocyclohexa-1,5-dienyl)-3-oxo-3-phenylpropanenitrile and (2E)-3-Hydroxy-2-(6-methyl-3,4-dioxocyclohexa-1,5-dienyl)-3-phenylprop-2-enenitrile1,5-dienyl)-3-phenylprop-2-enenitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H22N2O6 |
| InChI |
InChI=1S/2C16H11NO3/c2*1-10-7-14(18)15(19)8-12(10)13(9-17)16(20)11-5-3-2-4-6-11/h2-8,20H,1H3;2-8,13H,1H3/b16-13-; |
| InChIKey |
ZJXVRWNTPHVMPK-UNVLYCKESA-N |
| Literature Reference DOI |
10.1002/hlca.201200029 |
| Molecular Weight |
265.268 g/mol |
| SMILES |
O\C(=C\(C#N)C1=CC(C(C=C1C)=O)=O)c1ccccc1.C(C(C1=CC(=O)C(C=C1C)=O)C(c1ccccc1)=O)#N |
| SPLASH |
splash10-056r-9820000000-43128d1019501730c3f9 |
| Source of Spectrum |
H-95-1611-5c+6c |
| Synonyms |
(E)-3-hydroxy-2-(6-methyl-3,4-dioxocyclohexa-1,5-dien-1-yl)-3-phenylacrylonitrile-2-(6-methyl-3,4-dioxocyclohexa-1,5-dien-1-yl)-3-oxo-3-phenylpropanenitrile (1/1) |
| Wiley ID |
1784470 |
