CID 9558299

N'-(2-furylmethylene)-2-iodobenzohydrazide

Structural Information

Molecular Formula
C12H9IN2O2
SMILES
C1=CC=C(C(=C1)C(=O)N/N=C/C2=CC=CO2)I
InChI
InChI=1S/C12H9IN2O2/c13-11-6-2-1-5-10(11)12(16)15-14-8-9-4-3-7-17-9/h1-8H,(H,15,16)/b14-8+
InChIKey
KBTHKHIRKQZIAD-RIYZIHGNSA-N
Compound name
N-[(E)-furan-2-ylmethylideneamino]-2-iodobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.9709 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.97818 165.6
[M+Na]+ 362.96012 165.5
[M-H]- 338.96362 167.0
[M+NH4]+ 358.00472 178.6
[M+K]+ 378.93406 169.7
[M+H-H2O]+ 322.96816 154.2
[M+HCOO]- 384.96910 187.9
[M+CH3COO]- 398.98475 202.0
[M+Na-2H]- 360.94557 159.1
[M]+ 339.97035 163.9
[M]- 339.97145 163.9
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.