CID 9841259

Ar-m1000390

Structural Information

Molecular Formula
C23H28N2O
SMILES
CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCNCC2)C3=CC=CC=C3
InChI
InChI=1S/C23H28N2O/c1-3-25(4-2)23(26)21-12-10-19(11-13-21)22(18-8-6-5-7-9-18)20-14-16-24-17-15-20/h5-13,24H,3-4,14-17H2,1-2H3
InChIKey
SMUGAZNLKPFBSB-UHFFFAOYSA-N
Compound name
N,N-diethyl-4-[phenyl(piperidin-4-ylidene)methyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

46
Patents

348.22015 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.22743 187.5
[M+Na]+ 371.20937 188.0
[M-H]- 347.21287 193.6
[M+NH4]+ 366.25397 197.4
[M+K]+ 387.18331 182.7
[M+H-H2O]+ 331.21741 176.8
[M+HCOO]- 393.21835 203.0
[M+CH3COO]- 407.23400 216.2
[M+Na-2H]- 369.19482 186.5
[M]+ 348.21960 180.8
[M]- 348.22070 180.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe