CID 57281

Acetamide, n-(2-(diethylamino)ethyl)-2,2-diphenyl-n-(4-pyridylmethyl)-, hydrochloride

Structural Information

Molecular Formula
C26H31N3O
SMILES
CCN(CC)CCN(CC1=CC=NC=C1)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C26H31N3O/c1-3-28(4-2)19-20-29(21-22-15-17-27-18-16-22)26(30)25(23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-18,25H,3-4,19-21H2,1-2H3
InChIKey
GALRDSBFZTVEQM-UHFFFAOYSA-N
Compound name
N-[2-(diethylamino)ethyl]-2,2-diphenyl-N-(pyridin-4-ylmethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

401.2467 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 402.253976 202.5
[M+Na]+ 424.235918 203.0
[M-H]- 400.239424 211.3
[M+NH4]+ 419.280523 211.0
[M+K]+ 440.209858 199.2
[M+H-H2O]+ 384.243960 189.9
[M+HCOO]- 446.244901 223.9
[M+CH3COO]- 460.260551 234.7
[M+Na-2H]- 422.221366 203.9
[M]+ 401.24615142 203.7
[M]- 401.24724858 203.7
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.