CID 44211

Brn 1662269

Structural Information

Molecular Formula
C26H37N3O
SMILES
CCN(CC)CC(CN1CCCCC1)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C26H37N3O/c1-3-28(4-2)20-24(21-29-18-12-7-13-19-29)27-26(30)25(22-14-8-5-9-15-22)23-16-10-6-11-17-23/h5-6,8-11,14-17,24-25H,3-4,7,12-13,18-21H2,1-2H3,(H,27,30)
InChIKey
HKEQZUASBCOBDV-UHFFFAOYSA-N
Compound name
N-[1-(diethylamino)-3-piperidin-1-ylpropan-2-yl]-2,2-diphenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

407.29367 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 408.30095 203.9
[M+Na]+ 430.28289 200.9
[M-H]- 406.28639 210.1
[M+NH4]+ 425.32749 211.2
[M+K]+ 446.25683 197.0
[M+H-H2O]+ 390.29093 191.8
[M+HCOO]- 452.29187 219.6
[M+CH3COO]- 466.30752 233.5
[M+Na-2H]- 428.26834 202.0
[M]+ 407.29312 199.1
[M]- 407.29422 199.1
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.