CID 125511680
2-(4-ethynylcyclohexyl)-1,3-dioxolane
Structural Information
- Molecular Formula
- C11H16O2
- SMILES
- C#CC1CCC(CC1)C2OCCO2
- InChI
- InChI=1S/C11H16O2/c1-2-9-3-5-10(6-4-9)11-12-7-8-13-11/h1,9-11H,3-8H2
- InChIKey
- PBZXXFZDHVBOEK-UHFFFAOYSA-N
- Compound name
- 2-(4-ethynylcyclohexyl)-1,3-dioxolane
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 181.12232 | 135.3 |
[M+Na]+ | 203.10426 | 143.1 |
[M-H]- | 179.10776 | 139.9 |
[M+NH4]+ | 198.14886 | 152.0 |
[M+K]+ | 219.07820 | 140.4 |
[M+H-H2O]+ | 163.11230 | 123.6 |
[M+HCOO]- | 225.11324 | 148.0 |
[M+CH3COO]- | 239.12889 | 186.8 |
[M+Na-2H]- | 201.08971 | 138.6 |
[M]+ | 180.11449 | 126.2 |
[M]- | 180.11559 | 126.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.