| SpectraBase Spectrum ID |
IXRfhHzaPKB |
| Name |
8-Octyl-7-oxo-7H-benzocycloheptene-6-carboxylic acid ethyl ester |
| Alternate Name(s) |
Ethyl 7-Octylbenzotropone-2-carboxylate
Ethyl 8-octyl-7-oxo-7H-benzo[a]cycloheptene-6-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O3 |
| InChI |
InChI=1S/C22H28O3/c1-3-5-6-7-8-9-14-19-15-17-12-10-11-13-18(17)16-20(21(19)23)22(24)25-4-2/h10-13,15-16H,3-9,14H2,1-2H3 |
| InChIKey |
GLIQTKLBSNLDKH-UHFFFAOYSA-N |
| Molecular Weight |
340.463 g/mol |
| SMILES |
C=1(C(C(=Cc2c(C1)cccc2)CCCCCCCC)=O)C(=O)OCC |
| SPLASH |
splash10-03ea-0609000000-8619144f127bd01d83a4 |
| Source of Spectrum |
F-69-3421-3 |
| Wiley ID |
1595054 |
