| SpectraBase Spectrum ID |
5tBhh7LgQWM |
| Name |
2-Cycloheptyl-3-hydroxy-5-pentylcyclohexa-2,5-diene-1,4-dione |
| Appearance |
Bright orange prisms |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H26O3 |
| InChI |
InChI=1S/C18H26O3/c1-2-3-6-11-14-12-15(19)16(18(21)17(14)20)13-9-7-4-5-8-10-13/h12-13,21H,2-11H2,1H3 |
| InChIKey |
ABZXKSWVVWOTMP-UHFFFAOYSA-N |
| Instrument Name |
Fisons VG70-SE or Thermo Finnigan MAT900xp |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/cmdc.201900548 |
| Molecular Weight |
290.403 g/mol |
| Reported Formula |
C18H26O3 |
| SMILES |
OC1=C(C(C=C(C1=O)CCCCC)=O)C1CCCCCC1 |
| SPLASH |
splash10-0pbc-0390000000-e5dda5807f4a3749918f |
| Source of Spectrum |
CMC-15-SM33-9q |
| Wiley ID |
1839978 |
