CID 135870232

Chembl3422374

Structural Information

Molecular Formula
C14H14N2O3
SMILES
CC1=C(C=CO1)C(=O)N/N=C(/C)\C2=CC=CC=C2O
InChI
InChI=1S/C14H14N2O3/c1-9(11-5-3-4-6-13(11)17)15-16-14(18)12-7-8-19-10(12)2/h3-8,17H,1-2H3,(H,16,18)/b15-9-
InChIKey
FYOSVRCALVWUKM-DHDCSXOGSA-N
Compound name
N-[(Z)-1-(2-hydroxyphenyl)ethylideneamino]-2-methylfuran-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

258.10043 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.10771 159.9
[M+Na]+ 281.08965 170.2
[M+NH4]+ 276.13425 166.5
[M+K]+ 297.06359 167.3
[M-H]- 257.09315 164.4
[M+Na-2H]- 279.07510 165.7
[M]+ 258.09988 162.3
[M]- 258.10098 162.3
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