| SpectraBase Spectrum ID |
BpW5IVjxf1D |
| Name |
1-(1-Hydroxy-2-heptyn-1-yl)-2-(2-phenylethynyl)cycloheptene |
| Alternate Name(s) |
1-[2-(phenylethynyl)-1-cyclohepten-1-yl]-2-heptyn-1-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26O |
| InChI |
InChI=1S/C22H26O/c1-2-3-4-11-16-22(23)21-15-10-6-9-14-20(21)18-17-19-12-7-5-8-13-19/h5,7-8,12-13,22-23H,2-4,6,9-10,14-15H2,1H3 |
| InChIKey |
VENMJIMNQBWGAZ-UHFFFAOYSA-N |
| Molecular Weight |
306.449 g/mol |
| SMILES |
OC(C1=C(CCCCC1)C#Cc1ccccc1)C#CCCCC |
| SPLASH |
splash10-052r-0095000000-b5fe8ad12571e76e8060 |
| Source of Spectrum |
K-2001-1336-3 |
| Wiley ID |
1580406 |
