CID 23080684

N-methylpyridazin-4-amine

Structural Information

Molecular Formula
C5H7N3
SMILES
CNC1=CN=NC=C1
InChI
InChI=1S/C5H7N3/c1-6-5-2-3-7-8-4-5/h2-4H,1H3,(H,6,7)
InChIKey
IYYGTADJURIVJO-UHFFFAOYSA-N
Compound name
N-methylpyridazin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

156
Patents

109.063995 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.071271 118.5
[M+Na]+ 132.053213 126.9
[M-H]- 108.056719 119.7
[M+NH4]+ 127.097818 138.4
[M+K]+ 148.027153 125.7
[M+H-H2O]+ 92.061255 111.5
[M+HCOO]- 154.062196 142.9
[M+CH3COO]- 168.077846 169.4
[M+Na-2H]- 130.038661 129.5
[M]+ 109.06344642 117.3
[M]- 109.06454358 117.3
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