CID 16729502

N-(benzenecarboximidoyl)furan-3-carboxamide

Structural Information

Molecular Formula
C12H10N2O2
SMILES
C1=CC=C(C=C1)C(=NC(=O)C2=COC=C2)N
InChI
InChI=1S/C12H10N2O2/c13-11(9-4-2-1-3-5-9)14-12(15)10-6-7-16-8-10/h1-8H,(H2,13,14,15)
InChIKey
DWOPFBGJAQQZLH-UHFFFAOYSA-N
Compound name
N-[amino(phenyl)methylidene]furan-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

214.07423 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.08151 147.1
[M+Na]+ 237.06345 153.3
[M-H]- 213.06695 155.5
[M+NH4]+ 232.10805 165.4
[M+K]+ 253.03739 152.3
[M+H-H2O]+ 197.07149 139.7
[M+HCOO]- 259.07243 173.8
[M+CH3COO]- 273.08808 190.5
[M+Na-2H]- 235.04890 152.3
[M]+ 214.07368 146.3
[M]- 214.07478 146.3
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.