CID 99740

19247-68-8

Structural Information

Molecular Formula
C16H12N2O2
SMILES
C1=COC(=C1)C=NC2=CC=C(C=C2)N=CC3=CC=CO3
InChI
InChI=1S/C16H12N2O2/c1-3-15(19-9-1)11-17-13-5-7-14(8-6-13)18-12-16-4-2-10-20-16/h1-12H
InChIKey
ZEJSGZOZUFRALE-UHFFFAOYSA-N
Compound name
1-(furan-2-yl)-N-[4-(furan-2-ylmethylideneamino)phenyl]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.08987 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.09715 159.8
[M+Na]+ 287.07909 174.0
[M+NH4]+ 282.12369 168.5
[M+K]+ 303.05303 169.7
[M-H]- 263.08259 169.6
[M+Na-2H]- 285.06454 170.3
[M]+ 264.08932 164.7
[M]- 264.09042 164.7
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.