CID 7265

2-amino-4-chlorophenol

Structural Information

Molecular Formula
C6H6ClNO
SMILES
C1=CC(=C(C=C1Cl)N)O
InChI
InChI=1S/C6H6ClNO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H,8H2
InChIKey
SWFNPENEBHAHEB-UHFFFAOYSA-N
Compound name
2-amino-4-chlorophenol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

26
References

4700
Patents

143.0138 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.02108 123.0
[M+Na]+ 166.00302 136.6
[M+NH4]+ 161.04762 132.5
[M+K]+ 181.97696 130.3
[M-H]- 142.00652 125.8
[M+Na-2H]- 163.98847 130.5
[M]+ 143.01325 126.0
[M]- 143.01435 126.0
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