CID 3038472
Irampanel
Structural Information
- Molecular Formula
- C18H19N3O2
- SMILES
- CN(C)CCOC1=CC=CC=C1C2=NC(=NO2)C3=CC=CC=C3
- InChI
- InChI=1S/C18H19N3O2/c1-21(2)12-13-22-16-11-7-6-10-15(16)18-19-17(20-23-18)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3
- InChIKey
- QZULPCPLWGCGSL-UHFFFAOYSA-N
- Compound name
- N,N-dimethyl-2-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]ethanamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 310.15502 | 173.0 |
[M+Na]+ | 332.13696 | 187.7 |
[M+NH4]+ | 327.18156 | 180.6 |
[M+K]+ | 348.11090 | 182.1 |
[M-H]- | 308.14046 | 180.1 |
[M+Na-2H]- | 330.12241 | 183.0 |
[M]+ | 309.14719 | 177.2 |
[M]- | 309.14829 | 177.2 |