| SpectraBase Spectrum ID |
BCxrrn3Xef8 |
| Name |
Methyl (-)-3-(3-Oxocycloheptyl)butanoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H20O3 |
| InChI |
InChI=1S/C12H20O3/c1-9(7-12(14)15-2)10-5-3-4-6-11(13)8-10/h9-10H,3-8H2,1-2H3 |
| InChIKey |
JEDSXBNVWUWUGM-UHFFFAOYSA-N |
| Molecular Weight |
212.289 g/mol |
| SMILES |
C(CC(C)C1CC(CCCC1)=O)(=O)OC |
| SPLASH |
splash10-004i-0930000000-7445f8b993dfa377a877 |
| Source of Spectrum |
F-53-11234-0 |
| Wiley ID |
803293 |
