CID 3065929
(2-endo,3-exo)-2-bromo-7-oxabicyclo(2.2.1)heptane-2,3-dicarboxylic acid
Structural Information
- Molecular Formula
- C8H9BrO5
- SMILES
- C1CC2C(C(C1O2)C(=O)O)(C(=O)O)Br
- InChI
- InChI=1S/C8H9BrO5/c9-8(7(12)13)4-2-1-3(14-4)5(8)6(10)11/h3-5H,1-2H2,(H,10,11)(H,12,13)
- InChIKey
- HVZAZOJVFINJLF-UHFFFAOYSA-N
- Compound name
- 2-bromo-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 264.97063 | 152.6 |
[M+Na]+ | 286.95257 | 163.4 |
[M-H]- | 262.95607 | 156.4 |
[M+NH4]+ | 281.99717 | 176.7 |
[M+K]+ | 302.92651 | 154.5 |
[M+H-H2O]+ | 246.96061 | 155.8 |
[M+HCOO]- | 308.96155 | 167.2 |
[M+CH3COO]- | 322.97720 | 186.1 |
[M+Na-2H]- | 284.93802 | 156.5 |
[M]+ | 263.96280 | 170.9 |
[M]- | 263.96390 | 170.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.