CID 328197

64781-61-9

Structural Information

Molecular Formula
C19H19N5
SMILES
CCN(CC)C1=C(N=NC2=C3C=CC=CC3=NN21)C4=CC=CC=C4
InChI
InChI=1S/C19H19N5/c1-3-23(4-2)19-17(14-10-6-5-7-11-14)20-21-18-15-12-8-9-13-16(15)22-24(18)19/h5-13H,3-4H2,1-2H3
InChIKey
DMBNUXGIDGQCNQ-UHFFFAOYSA-N
Compound name
N,N-diethyl-3-phenyl-[1,2,4]triazino[4,3-b]indazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

317.16403 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.17131 176.6
[M+Na]+ 340.15325 186.6
[M-H]- 316.15675 181.7
[M+NH4]+ 335.19785 189.7
[M+K]+ 356.12719 180.2
[M+H-H2O]+ 300.16129 165.0
[M+HCOO]- 362.16223 196.9
[M+CH3COO]- 376.17788 187.4
[M+Na-2H]- 338.13870 183.6
[M]+ 317.16348 180.6
[M]- 317.16458 180.6
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

No patent data available for this compound.