CID 218218

40399-93-7

Structural Information

Molecular Formula
C19H29N3O
SMILES
CC1CN(CCN1CC(=O)N)C2(CCCC2)CC3=CC=CC=C3
InChI
InChI=1S/C19H29N3O/c1-16-14-22(12-11-21(16)15-18(20)23)19(9-5-6-10-19)13-17-7-3-2-4-8-17/h2-4,7-8,16H,5-6,9-15H2,1H3,(H2,20,23)
InChIKey
RGHVZXKPHKNWHD-UHFFFAOYSA-N
Compound name
2-[4-(1-benzylcyclopentyl)-2-methylpiperazin-1-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.23105 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.23833 179.9
[M+Na]+ 338.22027 189.1
[M+NH4]+ 333.26487 188.4
[M+K]+ 354.19421 182.3
[M-H]- 314.22377 184.2
[M+Na-2H]- 336.20572 186.6
[M]+ 315.23050 182.2
[M]- 315.23160 182.2
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.