CID 9570203

Furfuraldazine

Structural Information

Molecular Formula

C₁₀H₈N₂O₂

SMILES

C1=COC(=C1)/C=N/N=C/C2=CC=CO2

InChI

InChI=1S/C10H8N2O2/c1-3-9(13-5-1)7-11-12-8-10-4-2-6-14-10/h1-8H/b11-7+,12-8+

InChIKey

BLMWHISHMGJKFX-MKICQXMISA-N

Compound name

(E)-1-(furan-2-yl)-N-[(E)-furan-2-ylmethylideneamino]methanimine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 10
Patents: 188.05858 Da
Monoisotopic Mass: 2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	189.06586	138.9
[M+Na]+	211.04780	150.9
[M+NH4]+	206.09240	147.3
[M+K]+	227.02174	148.2
[M-H]-	187.05130	146.0
[M+Na-2H]-	209.03325	147.1
[M]+	188.05803	142.5
[M]-	188.05913	142.5

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.