CID 151517

2-chlorophenylhydroxylamine

Structural Information

Molecular Formula
C6H6ClNO
SMILES
C1=CC=C(C(=C1)NO)Cl
InChI
InChI=1S/C6H6ClNO/c7-5-3-1-2-4-6(5)8-9/h1-4,8-9H
InChIKey
JBGGHWCSFZVUFV-UHFFFAOYSA-N
Compound name
N-(2-chlorophenyl)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

56
Patents

143.0138 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.02108 123.6
[M+Na]+ 166.00302 132.8
[M-H]- 142.00652 126.4
[M+NH4]+ 161.04762 145.3
[M+K]+ 181.97696 129.1
[M+H-H2O]+ 126.01106 119.6
[M+HCOO]- 188.01200 144.4
[M+CH3COO]- 202.02765 171.4
[M+Na-2H]- 163.98847 132.1
[M]+ 143.01325 123.6
[M]- 143.01435 123.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe