CID 235665

2,2-dichloro-n-(2,6-dimethylphenyl)acetamide

Structural Information

Molecular Formula
C10H11Cl2NO
SMILES
CC1=C(C(=CC=C1)C)NC(=O)C(Cl)Cl
InChI
InChI=1S/C10H11Cl2NO/c1-6-4-3-5-7(2)8(6)13-10(14)9(11)12/h3-5,9H,1-2H3,(H,13,14)
InChIKey
ZBRUDTTYIRXMSM-UHFFFAOYSA-N
Compound name
2,2-dichloro-N-(2,6-dimethylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

231.02177 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.02905 146.5
[M+Na]+ 254.01099 155.6
[M-H]- 230.01449 149.9
[M+NH4]+ 249.05559 165.9
[M+K]+ 269.98493 150.7
[M+H-H2O]+ 214.01903 142.7
[M+HCOO]- 276.01997 160.7
[M+CH3COO]- 290.03562 192.1
[M+Na-2H]- 251.99644 149.4
[M]+ 231.02122 149.4
[M]- 231.02232 149.4
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