CID 53402962

6-cyclopropylpyridazin-3(2h)-one

Structural Information

Molecular Formula
C7H8N2O
SMILES
C1CC1C2=NNC(=O)C=C2
InChI
InChI=1S/C7H8N2O/c10-7-4-3-6(8-9-7)5-1-2-5/h3-5H,1-2H2,(H,9,10)
InChIKey
DFNMWYPHXDMYBS-UHFFFAOYSA-N
Compound name
3-cyclopropyl-1H-pyridazin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

136.06366 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.07094 129.6
[M+Na]+ 159.05288 144.4
[M+NH4]+ 154.09748 138.3
[M+K]+ 175.02682 139.6
[M-H]- 135.05638 138.4
[M+Na-2H]- 157.03833 139.9
[M]+ 136.06311 135.2
[M]- 136.06421 135.2
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

patents stripe