CID 3050164

Compound 775-679

Structural Information

Molecular Formula
C20H26N4O
SMILES
C1CN(CCN1CCNC2=CC=CC=C2C(=O)N)CC3=CC=CC=C3
InChI
InChI=1S/C20H26N4O/c21-20(25)18-8-4-5-9-19(18)22-10-11-23-12-14-24(15-13-23)16-17-6-2-1-3-7-17/h1-9,22H,10-16H2,(H2,21,25)
InChIKey
IGGLMKPPGKOHEQ-UHFFFAOYSA-N
Compound name
2-[2-(4-benzylpiperazin-1-yl)ethylamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

338.21066 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.21794 184.4
[M+Na]+ 361.19988 195.9
[M+NH4]+ 356.24448 191.1
[M+K]+ 377.17382 188.1
[M-H]- 337.20338 190.2
[M+Na-2H]- 359.18533 192.5
[M]+ 338.21011 187.4
[M]- 338.21121 187.4
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

patents stripe