CID 215320

3(2h)-pyridazinone, 6-phenyl-2-(piperidino)methyl-

Structural Information

Molecular Formula
C16H19N3O
SMILES
C1CCN(CC1)CN2C(=O)C=CC(=N2)C3=CC=CC=C3
InChI
InChI=1S/C16H19N3O/c20-16-10-9-15(14-7-3-1-4-8-14)17-19(16)13-18-11-5-2-6-12-18/h1,3-4,7-10H,2,5-6,11-13H2
InChIKey
ZCDJBQCGMYTBHB-UHFFFAOYSA-N
Compound name
6-phenyl-2-(piperidin-1-ylmethyl)pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.1528 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.16008 164.2
[M+Na]+ 292.14202 170.2
[M-H]- 268.14552 168.7
[M+NH4]+ 287.18662 175.5
[M+K]+ 308.11596 164.7
[M+H-H2O]+ 252.15006 152.6
[M+HCOO]- 314.15100 181.0
[M+CH3COO]- 328.16665 173.9
[M+Na-2H]- 290.12747 169.0
[M]+ 269.15225 159.7
[M]- 269.15335 159.7
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.