CID 6103419

4,4'-stilbenedicarbonyl chloride

Structural Information

Molecular Formula
C16H10Cl2O2
SMILES
C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)C(=O)Cl)C(=O)Cl
InChI
InChI=1S/C16H10Cl2O2/c17-15(19)13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)16(18)20/h1-10H/b2-1+
InChIKey
ZKXGEOSWQSVEBT-OWOJBTEDSA-N
Compound name
4-[(E)-2-(4-carbonochloridoylphenyl)ethenyl]benzoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

304.0058 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.013076 163.4
[M+Na]+ 326.995018 172.6
[M-H]- 302.998524 169.5
[M+NH4]+ 322.039623 179.6
[M+K]+ 342.968958 165.4
[M+H-H2O]+ 287.003060 157.7
[M+HCOO]- 349.004001 176.6
[M+CH3COO]- 363.019651 201.0
[M+Na-2H]- 324.980466 165.5
[M]+ 304.00525142 167.1
[M]- 304.00634858 167.1
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

patents stripe