CID 9552151

Brn 0415464

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]+ 298.19138 172.8
[M+Na]+ 320.17332 176.4
[M-H]- 296.17682 179.6
[M+NH4]+ 315.21792 186.6
[M+K]+ 336.14726 173.9
[M+H-H2O]+ 280.18136 162.2
[M+HCOO]- 342.18230 197.9
[M+CH3COO]- 356.19795 213.8
[M+Na-2H]- 318.15877 178.1
[M]+ 297.18355 175.4
[M]- 297.18465 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.