CID 593041

N-(2,6-dichlorophenyl)formamide

Structural Information

Molecular Formula
C7H5Cl2NO
SMILES
C1=CC(=C(C(=C1)Cl)NC=O)Cl
InChI
InChI=1S/C7H5Cl2NO/c8-5-2-1-3-6(9)7(5)10-4-11/h1-4H,(H,10,11)
InChIKey
CMRLEIHOFQKMCW-UHFFFAOYSA-N
Compound name
N-(2,6-dichlorophenyl)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

93
Patents

188.97482 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.982096 133.0
[M+Na]+ 211.964038 143.7
[M-H]- 187.967544 136.5
[M+NH4]+ 207.008643 154.0
[M+K]+ 227.937978 138.6
[M+H-H2O]+ 171.972080 129.5
[M+HCOO]- 233.973021 149.9
[M+CH3COO]- 247.988671 182.1
[M+Na-2H]- 209.949486 139.8
[M]+ 188.97427142 135.9
[M]- 188.97536858 135.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe