CID 2749748

1713-16-2

Structural Information

Molecular Formula
C10H8Cl2O2
SMILES
C1=CC(=CC(=C1)C(=O)CCl)C(=O)CCl
InChI
InChI=1S/C10H8Cl2O2/c11-5-9(13)7-2-1-3-8(4-7)10(14)6-12/h1-4H,5-6H2
InChIKey
AODZFAGHJHMZSC-UHFFFAOYSA-N
Compound name
2-chloro-1-[3-(2-chloroacetyl)phenyl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.99013 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.99741 144.1
[M+Na]+ 252.97935 158.0
[M+NH4]+ 248.02395 152.5
[M+K]+ 268.95329 150.9
[M-H]- 228.98285 145.5
[M+Na-2H]- 250.96480 150.7
[M]+ 229.98958 147.0
[M]- 229.99068 147.0
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.