CID 10012584
(2r,3r)-2-bromo-3-hydroxybutanoic acid
Structural Information
- Molecular Formula
- C4H7BrO3
- SMILES
- C[C@H]([C@H](C(=O)O)Br)O
- InChI
- InChI=1S/C4H7BrO3/c1-2(6)3(5)4(7)8/h2-3,6H,1H3,(H,7,8)/t2-,3-/m1/s1
- InChIKey
- LCHQHZMPERBYFH-PWNYCUMCSA-N
- Compound name
- (2R,3R)-2-bromo-3-hydroxybutanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 182.96514 | 130.6 |
[M+Na]+ | 204.94708 | 140.5 |
[M-H]- | 180.95058 | 131.2 |
[M+NH4]+ | 199.99168 | 152.3 |
[M+K]+ | 220.92102 | 131.0 |
[M+H-H2O]+ | 164.95512 | 131.4 |
[M+HCOO]- | 226.95606 | 147.5 |
[M+CH3COO]- | 240.97171 | 174.7 |
[M+Na-2H]- | 202.93253 | 134.8 |
[M]+ | 181.95731 | 147.2 |
[M]- | 181.95841 | 147.2 |