CID 3052749

69236-59-5

Structural Information

Molecular Formula
C8H13N3O2
SMILES
CCOC1=C(C=NN(C1=O)C)NC
InChI
InChI=1S/C8H13N3O2/c1-4-13-7-6(9-2)5-10-11(3)8(7)12/h5,9H,4H2,1-3H3
InChIKey
ONHMCGKGUBQDQV-UHFFFAOYSA-N
Compound name
4-ethoxy-2-methyl-5-(methylamino)pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

183.10077 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.108046 137.6
[M+Na]+ 206.089988 147.6
[M-H]- 182.093494 139.4
[M+NH4]+ 201.134593 155.3
[M+K]+ 222.063928 146.0
[M+H-H2O]+ 166.098030 130.3
[M+HCOO]- 228.098971 161.5
[M+CH3COO]- 242.114621 185.3
[M+Na-2H]- 204.075436 144.5
[M]+ 183.10022142 140.8
[M]- 183.10131858 140.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.