| SpectraBase Spectrum ID |
62HaSeRYJd0 |
| Name |
3-Cyano-3-(4-methoxy-3-hydroxyphenyl)isobenzofuran-1(3H)-one |
| Alternate Name(s) |
1-(3-hydroxy-4-methoxyphenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-carbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H11NO4 |
| InChI |
InChI=1S/C16H11NO4/c1-20-14-7-6-10(8-13(14)18)16(9-17)12-5-3-2-4-11(12)15(19)21-16/h2-8,18H,1H3 |
| InChIKey |
UIDDHUAGFZJASP-UHFFFAOYSA-N |
| Molecular Weight |
281.267 g/mol |
| SMILES |
Oc1cc(C2(OC(c3c2cccc3)=O)C#N)ccc1OC |
| SPLASH |
splash10-004i-0930000000-a3ec8e86a3b45e76c12d |
| Source of Spectrum |
F-57-328-37 |
| Wiley ID |
1549169 |
