CID 50988959

2-chloro-n-[(3,5-dichlorophenyl)methyl]-n-methylacetamide

Structural Information

Molecular Formula
C10H10Cl3NO
SMILES
CN(CC1=CC(=CC(=C1)Cl)Cl)C(=O)CCl
InChI
InChI=1S/C10H10Cl3NO/c1-14(10(15)5-11)6-7-2-8(12)4-9(13)3-7/h2-4H,5-6H2,1H3
InChIKey
IHXUALQEZXKETO-UHFFFAOYSA-N
Compound name
2-chloro-N-[(3,5-dichlorophenyl)methyl]-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.9828 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.99008 152.6
[M+Na]+ 287.97202 161.8
[M-H]- 263.97552 156.0
[M+NH4]+ 283.01662 171.1
[M+K]+ 303.94596 156.8
[M+H-H2O]+ 247.98006 149.0
[M+HCOO]- 309.98100 162.6
[M+CH3COO]- 323.99665 199.7
[M+Na-2H]- 285.95747 154.8
[M]+ 264.98225 157.3
[M]- 264.98335 157.3
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.