SpectraBase Spectrum ID |
EpdJ9ZhYOnZ |
Name |
(Z)-[(Ethoxycarbonyl)methylene]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 |
C13H14O3 |
InChI |
InChI=1S/C13H14O3/c1-2-16-13(15)8-10-7-9-3-5-11(10)12(14)6-4-9/h3-6,8-9,11H,2,7H2,1H3/b10-8- |
InChIKey |
RQQJGRUXKVXCTN-NTMALXAHSA-N |
Molecular Weight |
218.252 g/mol |
SMILES |
C12\C(CC(C=C2)C=CC1=O)=C/C(=O)OCC |
SPLASH |
splash10-004i-9020000000-0b4f805d234e661c09c3 |
Source of Spectrum |
F-49-6734-6 |
Wiley ID |
1217796 |