CID 89685

22390-38-1

Structural Information

Molecular Formula
C7H11N3O
SMILES
CC1=CC(=O)C(=NN1)N(C)C
InChI
InChI=1S/C7H11N3O/c1-5-4-6(11)7(9-8-5)10(2)3/h4H,1-3H3,(H,8,11)
InChIKey
JNMNEKBPYOEAJS-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-6-methyl-1H-pyridazin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.09021 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.09749 130.3
[M+Na]+ 176.07943 139.7
[M-H]- 152.08293 132.1
[M+NH4]+ 171.12403 149.0
[M+K]+ 192.05337 138.3
[M+H-H2O]+ 136.08747 123.4
[M+HCOO]- 198.08841 153.4
[M+CH3COO]- 212.10406 179.8
[M+Na-2H]- 174.06488 137.4
[M]+ 153.08966 130.7
[M]- 153.09076 130.7
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.