CID 58503

2,2-diphenyl-n-(2-pyridylmethyl)acetanilide hydrochloride

Structural Information

Molecular Formula
C26H22N2O
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)N(CC3=CC=CC=N3)C4=CC=CC=C4
InChI
InChI=1S/C26H22N2O/c29-26(25(21-12-4-1-5-13-21)22-14-6-2-7-15-22)28(24-17-8-3-9-18-24)20-23-16-10-11-19-27-23/h1-19,25H,20H2
InChIKey
DVCHEEAGIFVMCZ-UHFFFAOYSA-N
Compound name
N,2,2-triphenyl-N-(pyridin-2-ylmethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

378.17322 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.18050 192.9
[M+Na]+ 401.16244 195.3
[M-H]- 377.16594 203.7
[M+NH4]+ 396.20704 201.2
[M+K]+ 417.13638 189.5
[M+H-H2O]+ 361.17048 180.2
[M+HCOO]- 423.17142 213.7
[M+CH3COO]- 437.18707 201.2
[M+Na-2H]- 399.14789 196.9
[M]+ 378.17267 190.6
[M]- 378.17377 190.6
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.