CID 18112

2977-24-4

Structural Information

Molecular Formula
C22H35N3O
SMILES
C1CCN(CC1)CCC(CCN2CCCCC2)(C3=CC=CC=C3)C(=O)N
InChI
InChI=1S/C22H35N3O/c23-21(26)22(20-10-4-1-5-11-20,12-18-24-14-6-2-7-15-24)13-19-25-16-8-3-9-17-25/h1,4-5,10-11H,2-3,6-9,12-19H2,(H2,23,26)
InChIKey
TXSYVXMEIWQHCF-UHFFFAOYSA-N
Compound name
2-phenyl-4-piperidin-1-yl-2-(2-piperidin-1-ylethyl)butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.278 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.28528 192.3
[M+Na]+ 380.26722 200.7
[M+NH4]+ 375.31182 198.8
[M+K]+ 396.24116 193.7
[M-H]- 356.27072 196.5
[M+Na-2H]- 378.25267 198.1
[M]+ 357.27745 194.4
[M]- 357.27855 194.4
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

No patent data available for this compound.