CID 11275881
37172-56-8
Structural Information
- Molecular Formula
- C12H20O3
- SMILES
- CCCCCC1C(CCC1=O)C(=O)OC
- InChI
- InChI=1S/C12H20O3/c1-3-4-5-6-9-10(12(14)15-2)7-8-11(9)13/h9-10H,3-8H2,1-2H3
- InChIKey
- UQWSOBVONQGHLN-UHFFFAOYSA-N
- Compound name
- methyl 3-oxo-2-pentylcyclopentane-1-carboxylate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 213.14853 | 150.0 |
[M+Na]+ | 235.13047 | 156.2 |
[M-H]- | 211.13397 | 153.1 |
[M+NH4]+ | 230.17507 | 170.8 |
[M+K]+ | 251.10441 | 154.9 |
[M+H-H2O]+ | 195.13851 | 144.7 |
[M+HCOO]- | 257.13945 | 171.4 |
[M+CH3COO]- | 271.15510 | 188.0 |
[M+Na-2H]- | 233.11592 | 150.0 |
[M]+ | 212.14070 | 151.8 |
[M]- | 212.14180 | 151.8 |
Literature stripe
No literature data available for this compound.