CID 3068023
82619-95-2
Structural Information
- Molecular Formula
- C19H15N5O
- SMILES
- C1=CC=C(C=C1)N2C(=NN=C2NC3=CC=NC=C3)C4=CC=CC=C4O
- InChI
- InChI=1S/C19H15N5O/c25-17-9-5-4-8-16(17)18-22-23-19(21-14-10-12-20-13-11-14)24(18)15-6-2-1-3-7-15/h1-13,25H,(H,20,21,23)
- InChIKey
- DEIBCGHQBGZDHO-UHFFFAOYSA-N
- Compound name
- 2-[4-phenyl-5-(pyridin-4-ylamino)-1,2,4-triazol-3-yl]phenol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 330.13494 | 175.5 |
[M+Na]+ | 352.11688 | 183.7 |
[M-H]- | 328.12038 | 182.4 |
[M+NH4]+ | 347.16148 | 183.8 |
[M+K]+ | 368.09082 | 176.0 |
[M+H-H2O]+ | 312.12492 | 163.2 |
[M+HCOO]- | 374.12586 | 195.7 |
[M+CH3COO]- | 388.14151 | 185.2 |
[M+Na-2H]- | 350.10233 | 181.1 |
[M]+ | 329.12711 | 173.8 |
[M]- | 329.12821 | 173.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.