CID 87306
2-(3-bromophenyl)-1,3-dioxolane
Structural Information
- Molecular Formula
- C9H9BrO2
- SMILES
- C1COC(O1)C2=CC(=CC=C2)Br
- InChI
- InChI=1S/C9H9BrO2/c10-8-3-1-2-7(6-8)9-11-4-5-12-9/h1-3,6,9H,4-5H2
- InChIKey
- VYPYKCPWNPPBBX-UHFFFAOYSA-N
- Compound name
- 2-(3-bromophenyl)-1,3-dioxolane
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 228.98587 | 142.6 |
[M+Na]+ | 250.96781 | 146.3 |
[M+NH4]+ | 246.01241 | 148.3 |
[M+K]+ | 266.94175 | 147.9 |
[M-H]- | 226.97131 | 147.0 |
[M+Na-2H]- | 248.95326 | 146.2 |
[M]+ | 227.97804 | 143.3 |
[M]- | 227.97914 | 143.3 |