CID 81797982

3-[methyl(prop-2-yn-1-yl)amino]pyridazine-4-carbonitrile

Structural Information

Molecular Formula
C9H8N4
SMILES
CN(CC#C)C1=C(C=CN=N1)C#N
InChI
InChI=1S/C9H8N4/c1-3-6-13(2)9-8(7-10)4-5-11-12-9/h1,4-5H,6H2,2H3
InChIKey
AMWAJGUAYAMLIQ-UHFFFAOYSA-N
Compound name
3-[methyl(prop-2-ynyl)amino]pyridazine-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.07489 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.08217 165.1
[M+Na]+ 195.06411 174.1
[M+NH4]+ 190.10871 165.5
[M+K]+ 211.03805 163.7
[M-H]- 171.06761 154.7
[M+Na-2H]- 193.04956 164.8
[M]+ 172.07434 162.2
[M]- 172.07544 162.2
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.