CID 19831906

N-methylpyridazin-3-amine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

188
Patents

109.063995 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.07127 118.5
[M+Na]+ 132.05321 126.9
[M-H]- 108.05672 119.7
[M+NH4]+ 127.09782 138.4
[M+K]+ 148.02715 125.7
[M+H-H2O]+ 92.061255 111.5
[M+HCOO]- 154.06220 142.9
[M+CH3COO]- 168.07785 169.4
[M+Na-2H]- 130.03866 129.5
[M]+ 109.06345 117.3
[M]- 109.06454 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