CID 84868

2-chloro-n-(2,6-dichlorophenyl)-n-phenylacetamide

Structural Information

Molecular Formula
C14H10Cl3NO
SMILES
C1=CC=C(C=C1)N(C2=C(C=CC=C2Cl)Cl)C(=O)CCl
InChI
InChI=1S/C14H10Cl3NO/c15-9-13(19)18(10-5-2-1-3-6-10)14-11(16)7-4-8-12(14)17/h1-8H,9H2
InChIKey
BPEUHDIEZQWRGC-UHFFFAOYSA-N
Compound name
2-chloro-N-(2,6-dichlorophenyl)-N-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

312.9828 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.99008 164.8
[M+Na]+ 335.97202 173.7
[M-H]- 311.97552 170.8
[M+NH4]+ 331.01662 181.0
[M+K]+ 351.94596 167.6
[M+H-H2O]+ 295.98006 159.3
[M+HCOO]- 357.98100 174.9
[M+CH3COO]- 371.99665 206.9
[M+Na-2H]- 333.95747 167.4
[M]+ 312.98225 169.2
[M]- 312.98335 169.2
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