CID 211538

23338-54-7

Structural Information

Molecular Formula
C24H27N3O4
SMILES
COC1=CC=C(C=C1)C2=CC(=NN(C2=O)CCN3CCOCC3)C4=CC=C(C=C4)OC
InChI
InChI=1S/C24H27N3O4/c1-29-20-7-3-18(4-8-20)22-17-23(19-5-9-21(30-2)10-6-19)25-27(24(22)28)12-11-26-13-15-31-16-14-26/h3-10,17H,11-16H2,1-2H3
InChIKey
QSZZTUVGSBDMRA-UHFFFAOYSA-N
Compound name
4,6-bis(4-methoxyphenyl)-2-(2-morpholin-4-ylethyl)pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

421.20016 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 422.20744 205.6
[M+Na]+ 444.18938 211.4
[M-H]- 420.19288 214.0
[M+NH4]+ 439.23398 209.0
[M+K]+ 460.16332 206.8
[M+H-H2O]+ 404.19742 191.3
[M+HCOO]- 466.19836 220.1
[M+CH3COO]- 480.21401 213.0
[M+Na-2H]- 442.17483 206.5
[M]+ 421.19961 206.7
[M]- 421.20071 206.7
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.