CID 69983

4-chlorophenylhydroxylamine

Structural Information

Molecular Formula
C6H6ClNO
SMILES
C1=CC(=CC=C1NO)Cl
InChI
InChI=1S/C6H6ClNO/c7-5-1-3-6(8-9)4-2-5/h1-4,8-9H
InChIKey
VVQDMDRAUXFEND-UHFFFAOYSA-N
Compound name
N-(4-chlorophenyl)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

9
References

183
Patents

143.0138 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.021076 123.6
[M+Na]+ 166.003018 132.8
[M-H]- 142.006524 126.4
[M+NH4]+ 161.047623 145.3
[M+K]+ 181.976958 129.1
[M+H-H2O]+ 126.011060 119.6
[M+HCOO]- 188.012001 144.4
[M+CH3COO]- 202.027651 171.4
[M+Na-2H]- 163.988466 132.1
[M]+ 143.01325142 123.6
[M]- 143.01434858 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