CID 380040

N-allyl-n-(4-pyridylmethyl)benzilamide

Structural Information

Molecular Formula
C23H22N2O2
SMILES
C=CCN(CC1=CC=NC=C1)C(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C23H22N2O2/c1-2-17-25(18-19-13-15-24-16-14-19)22(26)23(27,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h2-16,27H,1,17-18H2
InChIKey
IBOKMCYIBFHZKK-UHFFFAOYSA-N
Compound name
2-hydroxy-2,2-diphenyl-N-prop-2-enyl-N-(pyridin-4-ylmethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.16812 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.17540 187.2
[M+Na]+ 381.15734 190.4
[M-H]- 357.16084 194.3
[M+NH4]+ 376.20194 196.7
[M+K]+ 397.13128 185.1
[M+H-H2O]+ 341.16538 176.5
[M+HCOO]- 403.16632 206.5
[M+CH3COO]- 417.18197 216.2
[M+Na-2H]- 379.14279 192.1
[M]+ 358.16757 185.9
[M]- 358.16867 185.9
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.