CID 16729505

Chembl242761

Structural Information

Molecular Formula
C14H16N2O2
SMILES
CN(C)C1=CC=C(C=C1)CNC(=O)C2=COC=C2
InChI
InChI=1S/C14H16N2O2/c1-16(2)13-5-3-11(4-6-13)9-15-14(17)12-7-8-18-10-12/h3-8,10H,9H2,1-2H3,(H,15,17)
InChIKey
YRCGNRJGPUUXSQ-UHFFFAOYSA-N
Compound name
N-[[4-(dimethylamino)phenyl]methyl]furan-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

244.12119 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.12847 156.9
[M+Na]+ 267.11041 162.7
[M-H]- 243.11391 165.7
[M+NH4]+ 262.15501 174.5
[M+K]+ 283.08435 162.2
[M+H-H2O]+ 227.11845 149.2
[M+HCOO]- 289.11939 183.3
[M+CH3COO]- 303.13504 199.8
[M+Na-2H]- 265.09586 161.3
[M]+ 244.12064 159.0
[M]- 244.12174 159.0
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

No patent data available for this compound.