CID 347531

N-benzylfuran-2-carboxamide

Structural Information

Molecular Formula
C12H11NO2
SMILES
C1=CC=C(C=C1)CNC(=O)C2=CC=CO2
InChI
InChI=1S/C12H11NO2/c14-12(11-7-4-8-15-11)13-9-10-5-2-1-3-6-10/h1-8H,9H2,(H,13,14)
InChIKey
SYUWFNHEYUYCHX-UHFFFAOYSA-N
Compound name
N-benzylfuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

23
Patents

201.07898 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.086256 142.9
[M+Na]+ 224.068198 149.5
[M-H]- 200.071704 150.3
[M+NH4]+ 219.112803 161.7
[M+K]+ 240.042138 148.1
[M+H-H2O]+ 184.076240 136.1
[M+HCOO]- 246.077181 168.5
[M+CH3COO]- 260.092831 184.1
[M+Na-2H]- 222.053646 149.5
[M]+ 201.07843142 143.4
[M]- 201.07952858 143.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe