CID 68563492
1240608-82-5
Structural Information
- Molecular Formula
- C4HBrN2O
- SMILES
- C1=C(N=C(O1)Br)C#N
- InChI
- InChI=1S/C4HBrN2O/c5-4-7-3(1-6)2-8-4/h2H
- InChIKey
- QEIQYGCSLLAGBE-UHFFFAOYSA-N
- Compound name
- 2-bromo-1,3-oxazole-4-carbonitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 172.93451 | 118.7 |
[M+Na]+ | 194.91645 | 133.9 |
[M-H]- | 170.91995 | 122.8 |
[M+NH4]+ | 189.96105 | 139.5 |
[M+K]+ | 210.89039 | 125.0 |
[M+H-H2O]+ | 154.92449 | 111.7 |
[M+HCOO]- | 216.92543 | 139.8 |
[M+CH3COO]- | 230.94108 | 187.1 |
[M+Na-2H]- | 192.90190 | 128.1 |
[M]+ | 171.92668 | 132.0 |
[M]- | 171.92778 | 132.0 |
Literature stripe
No literature data available for this compound.