CID 391403

Nsc690576

Structural Information

Molecular Formula
C6H8N6
SMILES
CN(C)C1=NN=CC2=NNN=C21
InChI
InChI=1S/C6H8N6/c1-12(2)6-5-4(3-7-10-6)8-11-9-5/h3H,1-2H3,(H,8,9,11)
InChIKey
FCHFKMLZUBBMHA-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2H-triazolo[4,5-d]pyridazin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.08104 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.08832 132.6
[M+Na]+ 187.07026 143.7
[M-H]- 163.07376 131.5
[M+NH4]+ 182.11486 149.2
[M+K]+ 203.04420 141.1
[M+H-H2O]+ 147.07830 123.4
[M+HCOO]- 209.07924 153.6
[M+CH3COO]- 223.09489 145.6
[M+Na-2H]- 185.05571 142.3
[M]+ 164.08049 134.1
[M]- 164.08159 134.1
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.