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]+ 294.123696 169.1
[M+Na]+ 316.105638 178.2
[M-H]- 292.109144 175.1
[M+NH4]+ 311.150243 179.9
[M+K]+ 332.079578 173.1
[M+H-H2O]+ 276.113680 157.5
[M+HCOO]- 338.114621 189.8
[M+CH3COO]- 352.130271 180.2
[M+Na-2H]- 314.091086 175.8
[M]+ 293.11587142 171.6
[M]- 293.11696858 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