CID 53425269
31709-51-0
Structural Information
- Molecular Formula
- C9H6FNO2
- SMILES
- C1C(=NOC1=O)C2=CC=C(C=C2)F
- InChI
- InChI=1S/C9H6FNO2/c10-7-3-1-6(2-4-7)8-5-9(12)13-11-8/h1-4H,5H2
- InChIKey
- SLAPGJIZFLGUQQ-UHFFFAOYSA-N
- Compound name
- 3-(4-fluorophenyl)-4H-1,2-oxazol-5-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 180.04553 | 135.9 |
[M+Na]+ | 202.02747 | 148.9 |
[M+NH4]+ | 197.07207 | 143.8 |
[M+K]+ | 218.00141 | 144.7 |
[M-H]- | 178.03097 | 138.7 |
[M+Na-2H]- | 200.01292 | 142.7 |
[M]+ | 179.03770 | 138.4 |
[M]- | 179.03880 | 138.4 |