CID 782465

332057-93-9

Structural Information

Molecular Formula
C15H10Cl2N2O2
SMILES
CNC(=O)/C(=C/C1=CC=C(O1)C2=C(C=C(C=C2)Cl)Cl)/C#N
InChI
InChI=1S/C15H10Cl2N2O2/c1-19-15(20)9(8-18)6-11-3-5-14(21-11)12-4-2-10(16)7-13(12)17/h2-7H,1H3,(H,19,20)/b9-6+
InChIKey
USFATLLHWITSBN-RMKNXTFCSA-N
Compound name
(E)-2-cyano-3-[5-(2,4-dichlorophenyl)furan-2-yl]-N-methylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.01193 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.019206 178.6
[M+Na]+ 343.001148 190.3
[M-H]- 319.004654 184.2
[M+NH4]+ 338.045753 192.8
[M+K]+ 358.975088 182.9
[M+H-H2O]+ 303.009190 166.3
[M+HCOO]- 365.010131 189.6
[M+CH3COO]- 379.025781 215.0
[M+Na-2H]- 340.986596 178.1
[M]+ 320.01138142 177.5
[M]- 320.01247858 177.5
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.