CID 113956

63867-61-8

Structural Information

Molecular Formula
C24H30N2O2
SMILES
CN(CCCCC1CCCN(C1)C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C24H30N2O2/c1-25(23(27)21-13-4-2-5-14-21)17-9-8-11-20-12-10-18-26(19-20)24(28)22-15-6-3-7-16-22/h2-7,13-16,20H,8-12,17-19H2,1H3
InChIKey
MXYRXKMNKUEGMW-UHFFFAOYSA-N
Compound name
N-[4-(1-benzoylpiperidin-3-yl)butyl]-N-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

378.23074 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.23802 195.2
[M+Na]+ 401.21996 195.5
[M-H]- 377.22346 202.4
[M+NH4]+ 396.26456 204.4
[M+K]+ 417.19390 191.4
[M+H-H2O]+ 361.22800 183.6
[M+HCOO]- 423.22894 212.0
[M+CH3COO]- 437.24459 223.6
[M+Na-2H]- 399.20541 194.0
[M]+ 378.23019 192.0
[M]- 378.23129 192.0
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.