CID 139594213

Ns00051603

Structural Information

Molecular Formula
C13H10Cl2N2O
SMILES
C1=CC=C(C(=C1)C(=NO)C2=C(C=CC(=C2)Cl)Cl)N
InChI
InChI=1S/C13H10Cl2N2O/c14-8-5-6-11(15)10(7-8)13(17-18)9-3-1-2-4-12(9)16/h1-7,18H,16H2
InChIKey
AQAJGYDOHHVGRB-UHFFFAOYSA-N
Compound name
N-[(2-aminophenyl)-(2,5-dichlorophenyl)methylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.01703 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.024306 160.2
[M+Na]+ 303.006248 169.6
[M-H]- 279.009754 166.2
[M+NH4]+ 298.050853 176.9
[M+K]+ 318.980188 162.8
[M+H-H2O]+ 263.014290 154.6
[M+HCOO]- 325.015231 176.1
[M+CH3COO]- 339.030881 201.3
[M+Na-2H]- 300.991696 163.7
[M]+ 280.01648142 161.4
[M]- 280.01757858 161.4
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.