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]+ 359.175396 187.2
[M+Na]+ 381.157338 190.4
[M-H]- 357.160844 194.3
[M+NH4]+ 376.201943 196.7
[M+K]+ 397.131278 185.1
[M+H-H2O]+ 341.165380 176.5
[M+HCOO]- 403.166321 206.5
[M+CH3COO]- 417.181971 216.2
[M+Na-2H]- 379.142786 192.1
[M]+ 358.16757142 185.9
[M]- 358.16866858 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.