CID 3041083
1-(4-chloromethyl-1,3-dioxolan-2-yl)-2-propanone
Structural Information
- Molecular Formula
- C7H11ClO3
- SMILES
- CC(=O)CC1OCC(O1)CCl
- InChI
- InChI=1S/C7H11ClO3/c1-5(9)2-7-10-4-6(3-8)11-7/h6-7H,2-4H2,1H3
- InChIKey
- UTSVYFOQXVPABD-UHFFFAOYSA-N
- Compound name
- 1-[4-(chloromethyl)-1,3-dioxolan-2-yl]propan-2-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 179.04695 | 136.5 |
[M+Na]+ | 201.02889 | 144.2 |
[M-H]- | 177.03239 | 141.0 |
[M+NH4]+ | 196.07349 | 156.5 |
[M+K]+ | 217.00283 | 144.4 |
[M+H-H2O]+ | 161.03693 | 132.6 |
[M+HCOO]- | 223.03787 | 152.7 |
[M+CH3COO]- | 237.05352 | 177.3 |
[M+Na-2H]- | 199.01434 | 141.0 |
[M]+ | 178.03912 | 139.8 |
[M]- | 178.04022 | 139.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.