CID 946089
111252-31-4
Structural Information
- Molecular Formula
- C7H5BrO3
- SMILES
- C1=C(OC(=C1)Br)/C=C/C(=O)O
- InChI
- InChI=1S/C7H5BrO3/c8-6-3-1-5(11-6)2-4-7(9)10/h1-4H,(H,9,10)/b4-2+
- InChIKey
- IIMYTCICBUBFJH-DUXPYHPUSA-N
- Compound name
- (E)-3-(5-bromofuran-2-yl)prop-2-enoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 216.94949 | 138.2 |
[M+Na]+ | 238.93143 | 150.3 |
[M-H]- | 214.93493 | 144.2 |
[M+NH4]+ | 233.97603 | 160.1 |
[M+K]+ | 254.90537 | 140.6 |
[M+H-H2O]+ | 198.93947 | 139.0 |
[M+HCOO]- | 260.94041 | 159.2 |
[M+CH3COO]- | 274.95606 | 179.1 |
[M+Na-2H]- | 236.91688 | 144.5 |
[M]+ | 215.94166 | 157.7 |
[M]- | 215.94276 | 157.7 |