CID 9581031

2,4-dichlorobenzamidoxime

Structural Information

Molecular Formula
C7H6Cl2N2O
SMILES
C1=CC(=C(C=C1Cl)Cl)/C(=N/O)/N
InChI
InChI=1S/C7H6Cl2N2O/c8-4-1-2-5(6(9)3-4)7(10)11-12/h1-3,12H,(H2,10,11)
InChIKey
MANQHFUAAAGDIX-UHFFFAOYSA-N
Compound name
2,4-dichloro-N'-hydroxybenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

18
Patents

203.98572 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.99300 139.0
[M+Na]+ 226.97494 148.6
[M-H]- 202.97844 142.1
[M+NH4]+ 222.01954 158.8
[M+K]+ 242.94888 143.6
[M+H-H2O]+ 186.98298 135.2
[M+HCOO]- 248.98392 155.4
[M+CH3COO]- 262.99957 186.6
[M+Na-2H]- 224.96039 143.6
[M]+ 203.98517 139.6
[M]- 203.98627 139.6
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.