CID 1552511

N-(4-benzylpiperazin-1-yl)-1-(4-ethylphenyl)methanimine

Structural Information

Molecular Formula
C20H25N3
SMILES
CCC1=CC=C(C=C1)C=NN2CCN(CC2)CC3=CC=CC=C3
InChI
InChI=1S/C20H25N3/c1-2-18-8-10-19(11-9-18)16-21-23-14-12-22(13-15-23)17-20-6-4-3-5-7-20/h3-11,16H,2,12-15,17H2,1H3
InChIKey
DOWZIOLVPXYXPC-UHFFFAOYSA-N
Compound name
N-(4-benzylpiperazin-1-yl)-1-(4-ethylphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

307.20483 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.21211 176.6
[M+Na]+ 330.19405 180.6
[M-H]- 306.19755 183.2
[M+NH4]+ 325.23865 188.3
[M+K]+ 346.16799 174.8
[M+H-H2O]+ 290.20209 164.8
[M+HCOO]- 352.20303 195.9
[M+CH3COO]- 366.21868 185.8
[M+Na-2H]- 328.17950 180.3
[M]+ 307.20428 172.7
[M]- 307.20538 172.7
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

No patent data available for this compound.