CID 89686

22390-46-1

Structural Information

Molecular Formula
C9H13N3O2
SMILES
CC1=CC(=O)C(=NN1)N2CCOCC2
InChI
InChI=1S/C9H13N3O2/c1-7-6-8(13)9(11-10-7)12-2-4-14-5-3-12/h6H,2-5H2,1H3,(H,10,13)
InChIKey
NPDBEUDAYBQLHV-UHFFFAOYSA-N
Compound name
6-methyl-3-morpholin-4-yl-1H-pyridazin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.10077 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.10805 143.2
[M+Na]+ 218.08999 150.7
[M-H]- 194.09349 144.8
[M+NH4]+ 213.13459 156.3
[M+K]+ 234.06393 148.4
[M+H-H2O]+ 178.09803 134.2
[M+HCOO]- 240.09897 159.0
[M+CH3COO]- 254.11462 179.4
[M+Na-2H]- 216.07544 149.4
[M]+ 195.10022 139.4
[M]- 195.10132 139.4
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.