CID 5333129

N'-{(e)-[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}benzohydrazide

Structural Information

Molecular Formula
C18H12Cl2N2O2
SMILES
C1=CC=C(C=C1)C(=O)N/N=C/C2=CC=C(O2)C3=C(C=CC(=C3)Cl)Cl
InChI
InChI=1S/C18H12Cl2N2O2/c19-13-6-8-16(20)15(10-13)17-9-7-14(24-17)11-21-22-18(23)12-4-2-1-3-5-12/h1-11H,(H,22,23)/b21-11+
InChIKey
MYKIHJVMFRBWTB-SRZZPIQSSA-N
Compound name
N-[(E)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.0276 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.034876 185.5
[M+Na]+ 381.016818 194.6
[M-H]- 357.020324 196.8
[M+NH4]+ 376.061423 199.9
[M+K]+ 396.990758 188.5
[M+H-H2O]+ 341.024860 177.8
[M+HCOO]- 403.025801 203.1
[M+CH3COO]- 417.041451 197.0
[M+Na-2H]- 379.002266 188.0
[M]+ 358.02705142 190.9
[M]- 358.02814858 190.9
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.