CID 9552151

Ketone, phenyl 2-pyridyl, o-(2-(diethylamino)ethyl)oxime

Structural Information

Molecular Formula
C18H23N3O
SMILES
CCN(CC)CCO/N=C(/C1=CC=CC=C1)\C2=CC=CC=N2
InChI
InChI=1S/C18H23N3O/c1-3-21(4-2)14-15-22-20-18(16-10-6-5-7-11-16)17-12-8-9-13-19-17/h5-13H,3-4,14-15H2,1-2H3/b20-18-
InChIKey
LURHNZKIXLOLQK-ZZEZOPTASA-N
Compound name
N,N-diethyl-2-[(Z)-[phenyl(pyridin-2-yl)methylidene]amino]oxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.1841 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.191376 172.8
[M+Na]+ 320.173318 176.4
[M-H]- 296.176824 179.6
[M+NH4]+ 315.217923 186.6
[M+K]+ 336.147258 173.9
[M+H-H2O]+ 280.181360 162.2
[M+HCOO]- 342.182301 197.9
[M+CH3COO]- 356.197951 213.8
[M+Na-2H]- 318.158766 178.1
[M]+ 297.18355142 175.4
[M]- 297.18464858 175.4
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.