CID 660590

N-(2,6-dichlorophenyl)cyclobutanecarboxamide

Structural Information

Molecular Formula
C11H11Cl2NO
SMILES
C1CC(C1)C(=O)NC2=C(C=CC=C2Cl)Cl
InChI
InChI=1S/C11H11Cl2NO/c12-8-5-2-6-9(13)10(8)14-11(15)7-3-1-4-7/h2,5-7H,1,3-4H2,(H,14,15)
InChIKey
JONFYQSLJNSWOY-UHFFFAOYSA-N
Compound name
N-(2,6-dichlorophenyl)cyclobutanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

12
Patents

243.02177 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.02905 144.6
[M+Na]+ 266.01099 154.1
[M+NH4]+ 261.05559 150.2
[M+K]+ 281.98493 148.5
[M-H]- 242.01449 146.0
[M+Na-2H]- 263.99644 150.2
[M]+ 243.02122 145.8
[M]- 243.02232 145.8
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