CID 11458782
90711-60-7
Structural Information
- Molecular Formula
- C5H7IO2
- SMILES
- C=CCOC(=O)CI
- InChI
- InChI=1S/C5H7IO2/c1-2-3-8-5(7)4-6/h2H,1,3-4H2
- InChIKey
- QZORKJQSVCOBNB-UHFFFAOYSA-N
- Compound name
- prop-2-enyl 2-iodoacetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 226.95636 | 133.0 |
[M+Na]+ | 248.93830 | 133.8 |
[M-H]- | 224.94180 | 126.8 |
[M+NH4]+ | 243.98290 | 150.4 |
[M+K]+ | 264.91224 | 139.4 |
[M+H-H2O]+ | 208.94634 | 125.0 |
[M+HCOO]- | 270.94728 | 151.6 |
[M+CH3COO]- | 284.96293 | 178.5 |
[M+Na-2H]- | 246.92375 | 126.5 |
[M]+ | 225.94853 | 132.2 |
[M]- | 225.94963 | 132.2 |