CID 3069021
84249-76-3
Structural Information
- Molecular Formula
- C15H14N4O2S
- SMILES
- COC1=CC=C(C=C1)NCN2C(=S)OC(=N2)C3=CC=NC=C3
- InChI
- InChI=1S/C15H14N4O2S/c1-20-13-4-2-12(3-5-13)17-10-19-15(22)21-14(18-19)11-6-8-16-9-7-11/h2-9,17H,10H2,1H3
- InChIKey
- GKFFLIJFJNMTFF-UHFFFAOYSA-N
- Compound name
- 3-[(4-methoxyanilino)methyl]-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 315.09102 | 170.1 |
[M+Na]+ | 337.07296 | 185.0 |
[M+NH4]+ | 332.11756 | 177.2 |
[M+K]+ | 353.04690 | 177.8 |
[M-H]- | 313.07646 | 176.2 |
[M+Na-2H]- | 335.05841 | 179.0 |
[M]+ | 314.08319 | 174.4 |
[M]- | 314.08429 | 174.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.