| SpectraBase Spectrum ID |
JRmolHPHrpN |
| Name |
(E,Z) and (E,Z)-1,6-Bis(5-Hydroxyhepta-1,3-dien-6-ynyl)cyclohepta-1,3,5-triene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H20O2 |
| InChI |
InChI=1S/C21H20O2/c1-3-20(22)15-9-7-13-18-11-5-6-12-19(17-18)14-8-10-16-21(23)4-2/h1-2,5-16,20-23H,17H2/b13-7-,14-8+,15-9+,16-10- |
| InChIKey |
DKBYCAPPHNSSQX-JJRHYHEDSA-N |
| Molecular Weight |
304.389 g/mol |
| SMILES |
OC(\C=C/C=C/C1=CC=CC=C(\C=C/C=C/C(C#C)O)C1)C#C |
| SPLASH |
splash10-0gb9-0907000000-8bd35b0baed325c38fcb |
| Source of Spectrum |
KC-0-1464-19 |
| Synonyms |
(4E,6Z)-7-{6-[(1E,3Z)-5-hydroxy-1,3-heptadien-6-ynyl]-1,3,5-cycloheptatrien-1-yl}-4,6-heptadien-1-yn-3-ol |
| Wiley ID |
781320 |
