CID 9575576

Benzenecarboximidamide, 2,4-dichloro-n'-[(cyclohexylcarbonyl)oxy]-

Structural Information

Molecular Formula
C14H16Cl2N2O2
SMILES
C1CCC(CC1)C(=O)O/N=C(/C2=C(C=C(C=C2)Cl)Cl)\N
InChI
InChI=1S/C14H16Cl2N2O2/c15-10-6-7-11(12(16)8-10)13(17)18-20-14(19)9-4-2-1-3-5-9/h6-9H,1-5H2,(H2,17,18)
InChIKey
INQSNRULMXCSQH-UHFFFAOYSA-N
Compound name
[(Z)-[amino-(2,4-dichlorophenyl)methylidene]amino] cyclohexanecarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

314.05887 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.06615 170.6
[M+Na]+ 337.04809 176.0
[M-H]- 313.05159 176.5
[M+NH4]+ 332.09269 185.9
[M+K]+ 353.02203 170.9
[M+H-H2O]+ 297.05613 164.4
[M+HCOO]- 359.05707 182.9
[M+CH3COO]- 373.07272 208.0
[M+Na-2H]- 335.03354 170.7
[M]+ 314.05832 169.4
[M]- 314.05942 169.4
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

No patent data available for this compound.