CID 23349712

Aqv9xb7kfi

Structural Information

Molecular Formula
C18H26Cl2N2O
SMILES
CCN(CC)C1CCCCC1N(C)C(=O)C2=CC(=C(C=C2)Cl)Cl
InChI
InChI=1S/C18H26Cl2N2O/c1-4-22(5-2)17-9-7-6-8-16(17)21(3)18(23)13-10-11-14(19)15(20)12-13/h10-12,16-17H,4-9H2,1-3H3
InChIKey
AXACJBKFKCCIOR-UHFFFAOYSA-N
Compound name
3,4-dichloro-N-[2-(diethylamino)cyclohexyl]-N-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

11
Patents

356.1422 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.14948 186.0
[M+Na]+ 379.13142 190.5
[M-H]- 355.13492 193.4
[M+NH4]+ 374.17602 200.9
[M+K]+ 395.10536 186.2
[M+H-H2O]+ 339.13946 179.1
[M+HCOO]- 401.14040 197.6
[M+CH3COO]- 415.15605 224.1
[M+Na-2H]- 377.11687 183.5
[M]+ 356.14165 188.3
[M]- 356.14275 188.3
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.