| SpectraBase Spectrum ID |
E54bznqkyP6 |
| Name |
1-(4,4-Dimethyl-2-oxazolino)-4-(phenylacetynyl)-1,3,5,7-cyclooctatetraene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H19NO |
| InChI |
InChI=1S/C21H19NO/c1-21(2)16-23-20(22-21)19-11-7-6-10-18(14-15-19)13-12-17-8-4-3-5-9-17/h3-11,14-15H,16H2,1-2H3/b7-6-,10-6-,11-7-,15-14-,18-10-,18-14+,19-11+,19-15+ |
| InChIKey |
BDGMJQIIVSZNHG-STGFBZNKSA-N |
| Molecular Weight |
301.389 g/mol |
| SMILES |
C1(=NC(C)(C)CO1)\C1=C\C=C\(C#Cc2ccccc2)\C=C/C=C\1 |
| SPLASH |
splash10-0udi-0019000000-d451920a70a04c97507f |
| Source of Spectrum |
J-56-5141-10 |
| Synonyms |
4,4-dimethyl-2-[4-(phenylethynyl)-1,3,5,7-cyclooctatetraenyl]-4,5-dihydro-1,3-oxazole |
| Wiley ID |
1304093 |
