CID 11736040

O-(3,5-dichlorophenyl)hydroxylamine

Structural Information

Molecular Formula
C6H5Cl2NO
SMILES
C1=C(C=C(C=C1Cl)Cl)ON
InChI
InChI=1S/C6H5Cl2NO/c7-4-1-5(8)3-6(2-4)10-9/h1-3H,9H2
InChIKey
PCSYDOORDVYWPI-UHFFFAOYSA-N
Compound name
O-(3,5-dichlorophenyl)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

176.97482 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.98210 129.8
[M+Na]+ 199.96404 140.6
[M-H]- 175.96754 132.9
[M+NH4]+ 195.00864 151.1
[M+K]+ 215.93798 136.0
[M+H-H2O]+ 159.97208 126.4
[M+HCOO]- 221.97302 146.2
[M+CH3COO]- 235.98867 179.4
[M+Na-2H]- 197.94949 136.1
[M]+ 176.97427 132.0
[M]- 176.97537 132.0
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

patents stripe