| SpectraBase Spectrum ID |
JCrGMUWxnwQ |
| Name |
2-Butyne-1,4-diol, 1-(2,3-dihydro-3,3-dimethyl-1H-inden-5-yl)-4-phenyl- |
| Alternate Name(s) |
1-(1,1-Methyl-6-indanyl)-4-phenyl-2-butyne-1,4-diol
1-(3,3-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-phenyl-2-butyne-1,4-diol |
| CAS Registry Number |
84680-79-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22O2 |
| InChI |
InChI=1S/C21H22O2/c1-21(2)13-12-15-8-9-17(14-18(15)21)20(23)11-10-19(22)16-6-4-3-5-7-16/h3-9,14,19-20,22-23H,12-13H2,1-2H3 |
| InChIKey |
DPZYXGYFSLCFNH-UHFFFAOYSA-N |
| Molecular Weight |
306.405 g/mol |
| SMILES |
OC(C#CC(c1cc2C(CCc2cc1)(C)C)O)c1ccccc1 |
| SPLASH |
splash10-0a4i-0009000000-e455f74ee0feb97ec3db |
| Source of Spectrum |
C-105-1711-0 |
| Wiley ID |
1308634 |
