CID 216499

37390-25-3

Structural Information

Molecular Formula
C22H28N2O
SMILES
CCC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)N3CCCCC3
InChI
InChI=1S/C22H28N2O/c1-2-20(24-16-10-5-11-17-24)22(25)23-21(18-12-6-3-7-13-18)19-14-8-4-9-15-19/h3-4,6-9,12-15,20-21H,2,5,10-11,16-17H2,1H3,(H,23,25)
InChIKey
REICTWYFOIZIPX-UHFFFAOYSA-N
Compound name
N-benzhydryl-2-piperidin-1-ylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.22015 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.227426 183.5
[M+Na]+ 359.209368 183.2
[M-H]- 335.212874 189.3
[M+NH4]+ 354.253973 193.7
[M+K]+ 375.183308 178.6
[M+H-H2O]+ 319.217410 172.7
[M+HCOO]- 381.218351 199.2
[M+CH3COO]- 395.234001 213.5
[M+Na-2H]- 357.194816 183.8
[M]+ 336.21960142 176.9
[M]- 336.22069858 176.9
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.