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
2
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]+ 177.982096 129.8
[M+Na]+ 199.964038 140.6
[M-H]- 175.967544 132.9
[M+NH4]+ 195.008643 151.1
[M+K]+ 215.937978 136.0
[M+H-H2O]+ 159.972080 126.4
[M+HCOO]- 221.973021 146.2
[M+CH3COO]- 235.988671 179.4
[M+Na-2H]- 197.949486 136.1
[M]+ 176.97427142 132.0
[M]- 176.97536858 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