CID 16778680

(3-amino-1-benzofuran-2-yl)(2,4-dichlorophenyl)methanone

Structural Information

Molecular Formula
C15H9Cl2NO2
SMILES
C1=CC=C2C(=C1)C(=C(O2)C(=O)C3=C(C=C(C=C3)Cl)Cl)N
InChI
InChI=1S/C15H9Cl2NO2/c16-8-5-6-9(11(17)7-8)14(19)15-13(18)10-3-1-2-4-12(10)20-15/h1-7H,18H2
InChIKey
JQUJYJFPXCWDPF-UHFFFAOYSA-N
Compound name
(3-amino-1-benzofuran-2-yl)-(2,4-dichlorophenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.00104 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.00832 164.4
[M+Na]+ 327.99026 181.4
[M+NH4]+ 323.03486 173.9
[M+K]+ 343.96420 174.6
[M-H]- 303.99376 170.9
[M+Na-2H]- 325.97571 172.5
[M]+ 305.00049 169.5
[M]- 305.00159 169.5
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.