| SpectraBase Spectrum ID |
afXdamKTdf |
| Name |
9-(Ethoxycarbonyl)-10-(1-methylpropylidene)bicyclo[3.2.2]nona-3,6-dien-2-one isomer |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H20O3 |
| InChI |
InChI=1S/C16H20O3/c1-3-19-16(18)9-4-11(2)14-10-13-6-5-12(14)7-8-15(13)17/h5-8,12-13H,3-4,9-10H2,1-2H3/t12-,13-/m0/s1 |
| InChIKey |
RPNVVWUYOPURPA-STQMWFEESA-N |
| Molecular Weight |
260.333 g/mol |
| SMILES |
C1(C[C@]2(C(=O)C=C[C@@]1(C=C2)[H])[H])=C(CCC(=O)OCC)C |
| SPLASH |
splash10-01p9-0970000000-bf29b039276e05150328 |
| Source of Spectrum |
F-49-6738-2 |
| Wiley ID |
1264081 |
![9-(Ethoxycarbonyl)-10-(1-methylpropylidene)bicyclo[3.2.2]nona-3,6-dien-2-one isomer](/api/spectrum/afXdamKTdf/structure.png?h=300&w=458 "9-(Ethoxycarbonyl)-10-(1-methylpropylidene)bicyclo[3.2.2]nona-3,6-dien-2-one isomer")
