CID 24847126

As-triazine, 5,6-bis(o-methoxyphenyl)-

Structural Information

Molecular Formula
C17H15N3O2
SMILES
COC1=CC=CC=C1C2=C(N=NC=N2)C3=CC=CC=C3OC
InChI
InChI=1S/C17H15N3O2/c1-21-14-9-5-3-7-12(14)16-17(20-19-11-18-16)13-8-4-6-10-15(13)22-2/h3-11H,1-2H3
InChIKey
PQQJVYQBIHZMLI-UHFFFAOYSA-N
Compound name
5,6-bis(2-methoxyphenyl)-1,2,4-triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

293.11642 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.12370 169.1
[M+Na]+ 316.10564 178.2
[M-H]- 292.10914 175.1
[M+NH4]+ 311.15024 179.9
[M+K]+ 332.07958 173.1
[M+H-H2O]+ 276.11368 157.5
[M+HCOO]- 338.11462 189.8
[M+CH3COO]- 352.13027 180.2
[M+Na-2H]- 314.09109 175.8
[M]+ 293.11587 171.6
[M]- 293.11697 171.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe