CID 22405549
(2-oxo-1,3-benzoxazol-3(2h)-yl)acetaldehyde
Structural Information
- Molecular Formula
- C9H7NO3
- SMILES
- C1=CC=C2C(=C1)N(C(=O)O2)CC=O
- InChI
- InChI=1S/C9H7NO3/c11-6-5-10-7-3-1-2-4-8(7)13-9(10)12/h1-4,6H,5H2
- InChIKey
- WQBHOOOBGMMTRI-UHFFFAOYSA-N
- Compound name
- 2-(2-oxo-1,3-benzoxazol-3-yl)acetaldehyde
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 178.04987 | 129.8 |
[M+Na]+ | 200.03181 | 142.2 |
[M-H]- | 176.03531 | 135.0 |
[M+NH4]+ | 195.07641 | 150.8 |
[M+K]+ | 216.00575 | 140.6 |
[M+H-H2O]+ | 160.03985 | 124.1 |
[M+HCOO]- | 222.04079 | 155.4 |
[M+CH3COO]- | 236.05644 | 177.8 |
[M+Na-2H]- | 198.01726 | 139.2 |
[M]+ | 177.04204 | 135.6 |
[M]- | 177.04314 | 135.6 |
Literature stripe
No literature data available for this compound.