CID 208804

Sep 352

Structural Information

Molecular Formula
C19H25N3O3
SMILES
CCCOC1=CC(=NN(C1=O)CCN2CCOCC2)C3=CC=CC=C3
InChI
InChI=1S/C19H25N3O3/c1-2-12-25-18-15-17(16-6-4-3-5-7-16)20-22(19(18)23)9-8-21-10-13-24-14-11-21/h3-7,15H,2,8-14H2,1H3
InChIKey
NBRLBCRGVCFMFV-UHFFFAOYSA-N
Compound name
2-(2-morpholin-4-ylethyl)-6-phenyl-4-propoxypyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.1896 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.19688 184.5
[M+Na]+ 366.17882 189.9
[M-H]- 342.18232 189.5
[M+NH4]+ 361.22342 191.6
[M+K]+ 382.15276 186.1
[M+H-H2O]+ 326.18686 172.1
[M+HCOO]- 388.18780 199.6
[M+CH3COO]- 402.20345 211.1
[M+Na-2H]- 364.16427 187.4
[M]+ 343.18905 184.8
[M]- 343.19015 184.8
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.