CID 198400
2,6,7-trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)-
Structural Information
- Molecular Formula
- C11H20O3
- SMILES
- CC(C)C12COC(OC1)(OC2)C(C)C
- InChI
- InChI=1S/C11H20O3/c1-8(2)10-5-12-11(9(3)4,13-6-10)14-7-10/h8-9H,5-7H2,1-4H3
- InChIKey
- QYPQGJPVSZEXAV-UHFFFAOYSA-N
- Compound name
- 1,4-di(propan-2-yl)-2,6,7-trioxabicyclo[2.2.2]octane
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 201.14853 | 145.9 |
[M+Na]+ | 223.13047 | 150.1 |
[M-H]- | 199.13397 | 144.5 |
[M+NH4]+ | 218.17507 | 169.2 |
[M+K]+ | 239.10441 | 153.1 |
[M+H-H2O]+ | 183.13851 | 141.2 |
[M+HCOO]- | 245.13945 | 152.8 |
[M+CH3COO]- | 259.15510 | 156.6 |
[M+Na-2H]- | 221.11592 | 158.4 |
[M]+ | 200.14070 | 150.6 |
[M]- | 200.14180 | 150.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.