| SpectraBase Spectrum ID |
JGbfXwRpNG0 |
| Name |
trans-2-Methyl-2-(phenylethynyl)-1-(propa-1,2-dien-1-yl)cyclohexanol |
| Alternate Name(s) |
(1S,2R)-2-methyl-2-(phenylethynyl)-1-(propa-1,2-dien-1-yl)cyclohexan-1-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20O |
| InChI |
InChI=1S/C18H20O/c1-3-12-18(19)14-8-7-13-17(18,2)15-11-16-9-5-4-6-10-16/h4-6,9-10,12,19H,1,7-8,13-14H2,2H3/t17-,18-/m1/s1 |
| InChIKey |
ANBRDVXWBRTAOJ-QZTJIDSGSA-N |
| Literature Reference DOI |
10.1021/acs.orglett.5b00348 |
| Molecular Weight |
252.357 g/mol |
| SMILES |
O[C@]1([C@](CCCC1)(C#Cc1ccccc1)C)C=C=C |
| SPLASH |
splash10-056u-2910000000-90eb7491086df59d4528 |
| Source of Spectrum |
A1-17-1465/SM7-3b |
| Wiley ID |
1805046 |
