CID 71683202
1171967-42-2
Structural Information
- Molecular Formula
- C7H11ClO3
- SMILES
- C1COCCC1COC(=O)Cl
- InChI
- InChI=1S/C7H11ClO3/c8-7(9)11-5-6-1-3-10-4-2-6/h6H,1-5H2
- InChIKey
- RTLJEJIZQVVBJA-UHFFFAOYSA-N
- Compound name
- oxan-4-ylmethyl carbonochloridate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 179.04695 | 134.6 |
[M+Na]+ | 201.02889 | 140.6 |
[M-H]- | 177.03239 | 138.0 |
[M+NH4]+ | 196.07349 | 153.9 |
[M+K]+ | 217.00283 | 140.2 |
[M+H-H2O]+ | 161.03693 | 130.0 |
[M+HCOO]- | 223.03787 | 149.9 |
[M+CH3COO]- | 237.05352 | 175.6 |
[M+Na-2H]- | 199.01434 | 140.3 |
[M]+ | 178.03912 | 134.9 |
[M]- | 178.04022 | 134.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.