CID 12164795

N-benzyl-n-(2-quinolinylmethyl)formamide

Structural Information

Molecular Formula
C18H16N2O
SMILES
C1=CC=C(C=C1)CN(CC2=NC3=CC=CC=C3C=C2)C=O
InChI
InChI=1S/C18H16N2O/c21-14-20(12-15-6-2-1-3-7-15)13-17-11-10-16-8-4-5-9-18(16)19-17/h1-11,14H,12-13H2
InChIKey
UCIKFROUISXGMV-UHFFFAOYSA-N
Compound name
N-benzyl-N-(quinolin-2-ylmethyl)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.12625 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.13353 164.5
[M+Na]+ 299.11547 180.3
[M+NH4]+ 294.16007 173.8
[M+K]+ 315.08941 170.7
[M-H]- 275.11897 170.7
[M+Na-2H]- 297.10092 175.3
[M]+ 276.12570 168.6
[M]- 276.12680 168.6
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.