CID 9575577

Benzenecarboximidamide, 2,4-dichloro-n'-[(2-furanylcarbonyl)oxy]-

Structural Information

Molecular Formula
C12H8Cl2N2O3
SMILES
C1=COC(=C1)C(=O)O/N=C(/C2=C(C=C(C=C2)Cl)Cl)\N
InChI
InChI=1S/C12H8Cl2N2O3/c13-7-3-4-8(9(14)6-7)11(15)16-19-12(17)10-2-1-5-18-10/h1-6H,(H2,15,16)
InChIKey
JEEPWLOOEIFXLW-UHFFFAOYSA-N
Compound name
[(Z)-[amino-(2,4-dichlorophenyl)methylidene]amino] furan-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

297.9912 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.99848 165.9
[M+Na]+ 320.98042 174.8
[M-H]- 296.98392 174.0
[M+NH4]+ 316.02502 182.5
[M+K]+ 336.95436 171.1
[M+H-H2O]+ 280.98846 160.0
[M+HCOO]- 342.98940 182.8
[M+CH3COO]- 357.00505 203.1
[M+Na-2H]- 318.96587 168.1
[M]+ 297.99065 170.7
[M]- 297.99175 170.7
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.