CID 128627

Ci 926

Structural Information

Molecular Formula
C18H26N4O2
SMILES
CC1=CC(=CC=C1)N2CCN(CC2)CCCCN3C(=O)CNC3=O
InChI
InChI=1S/C18H26N4O2/c1-15-5-4-6-16(13-15)21-11-9-20(10-12-21)7-2-3-8-22-17(23)14-19-18(22)24/h4-6,13H,2-3,7-12,14H2,1H3,(H,19,24)
InChIKey
SRAHKOZZGVIVTC-UHFFFAOYSA-N
Compound name
3-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

2
Patents

330.20557 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.21285 183.7
[M+Na]+ 353.19479 188.2
[M-H]- 329.19829 185.5
[M+NH4]+ 348.23939 192.6
[M+K]+ 369.16873 182.2
[M+H-H2O]+ 313.20283 172.3
[M+HCOO]- 375.20377 195.4
[M+CH3COO]- 389.21942 207.2
[M+Na-2H]- 351.18024 180.5
[M]+ 330.20502 178.3
[M]- 330.20612 178.3
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