CID 198705
115966-98-8
Structural Information
- Molecular Formula
- C11H12O4
- SMILES
- C1CC23C4CCC(C2(C1)C(=O)OC3=O)O4
- InChI
- InChI=1S/C11H12O4/c12-8-10-4-1-5-11(10,9(13)15-8)7-3-2-6(10)14-7/h6-7H,1-5H2
- InChIKey
- PEKHINVAKVDWJS-UHFFFAOYSA-N
- Compound name
- 8,13-dioxatetracyclo[4.3.3.12,5.01,6]tridecane-7,9-dione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 209.08084 | 142.7 |
[M+Na]+ | 231.06278 | 151.8 |
[M-H]- | 207.06628 | 150.7 |
[M+NH4]+ | 226.10738 | 171.8 |
[M+K]+ | 247.03672 | 151.2 |
[M+H-H2O]+ | 191.07082 | 142.2 |
[M+HCOO]- | 253.07176 | 161.5 |
[M+CH3COO]- | 267.08741 | 157.2 |
[M+Na-2H]- | 229.04823 | 145.9 |
[M]+ | 208.07301 | 143.8 |
[M]- | 208.07411 | 143.8 |
Literature stripe
No literature data available for this compound.