CID 23138

2-chloro-4-(phenylazo)phenol

Structural Information

Molecular Formula
C12H9ClN2O
SMILES
C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)O)Cl
InChI
InChI=1S/C12H9ClN2O/c13-11-8-10(6-7-12(11)16)15-14-9-4-2-1-3-5-9/h1-8,16H
InChIKey
UWKOOOMCKYNLFU-UHFFFAOYSA-N
Compound name
2-chloro-4-phenyldiazenylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

232.04034 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.04762 147.9
[M+Na]+ 255.02956 157.2
[M-H]- 231.03306 156.4
[M+NH4]+ 250.07416 166.9
[M+K]+ 271.00350 152.6
[M+H-H2O]+ 215.03760 141.0
[M+HCOO]- 277.03854 172.4
[M+CH3COO]- 291.05419 194.9
[M+Na-2H]- 253.01501 156.3
[M]+ 232.03979 150.5
[M]- 232.04089 150.5
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