CID 9578565

24342-50-5

Structural Information

Molecular Formula
C19H20N2O2
SMILES
C1CCN(CC1)/N=C/C(=O)C2=CC=C(C=C2)OC3=CC=CC=C3
InChI
InChI=1S/C19H20N2O2/c22-19(15-20-21-13-5-2-6-14-21)16-9-11-18(12-10-16)23-17-7-3-1-4-8-17/h1,3-4,7-12,15H,2,5-6,13-14H2/b20-15+
InChIKey
VTLFTZITBCZVNL-HMMYKYKNSA-N
Compound name
(2E)-1-(4-phenoxyphenyl)-2-piperidin-1-yliminoethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.15247 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.15975 174.5
[M+Na]+ 331.14169 187.8
[M+NH4]+ 326.18629 182.5
[M+K]+ 347.11563 179.2
[M-H]- 307.14519 181.0
[M+Na-2H]- 329.12714 184.5
[M]+ 308.15192 178.1
[M]- 308.15302 178.1
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.