CID 207196

Ag 252

Structural Information

Molecular Formula
C17H21N3O3
SMILES
CC1=CC(=NN(C1=O)CCN2CCOCC2)C3=CC=C(C=C3)O
InChI
InChI=1S/C17H21N3O3/c1-13-12-16(14-2-4-15(21)5-3-14)18-20(17(13)22)7-6-19-8-10-23-11-9-19/h2-5,12,21H,6-11H2,1H3
InChIKey
BIIAJTZFPIRKML-UHFFFAOYSA-N
Compound name
6-(4-hydroxyphenyl)-4-methyl-2-(2-morpholin-4-ylethyl)pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.1583 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.16558 175.9
[M+Na]+ 338.14752 190.7
[M+NH4]+ 333.19212 182.0
[M+K]+ 354.12146 183.9
[M-H]- 314.15102 180.9
[M+Na-2H]- 336.13297 183.2
[M]+ 315.15775 179.4
[M]- 315.15885 179.4
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.