| SpectraBase Spectrum ID |
JrKDVpGP0GT |
| Name |
Methyltribenzo[a,c,e]cyclooctatetraene |
| CAS Registry Number |
127709-92-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H16 |
| InChI |
InChI=1S/C21H16/c1-15-14-16-8-2-3-10-18(16)20-12-6-7-13-21(20)19-11-5-4-9-17(15)19/h2-14H,1H3/b15-14-,16-14-,17-15-,20-18-,21-19- |
| InChIKey |
KUQDDLMKUBJXRL-FFWMRNGWSA-N |
| Molecular Weight |
268.359 g/mol |
| SMILES |
c12\C=C/(c3c(-c4c(-c2cccc1)cccc4)cccc3)C |
| SPLASH |
splash10-0uxr-0090000000-c0135ee98245dbb65bc2 |
| Source of Spectrum |
K-123-2368-3 |
| Synonyms |
9-methyltribenzo[a,c,e]cyclooctene |
| Wiley ID |
1272901 |
![Methyltribenzo[a,c,e]cyclooctatetraene](/api/spectrum/JrKDVpGP0GT/structure.png?h=300&w=458 "Methyltribenzo[a,c,e]cyclooctatetraene")
