CID 459056

O-[p-(2-hydroxyethylamino)phenylazo]benzoic acid

Structural Information

Molecular Formula
C15H15N3O3
SMILES
C1=CC=C(C(=C1)C(=O)O)N=NC2=CC=C(C=C2)NCCO
InChI
InChI=1S/C15H15N3O3/c19-10-9-16-11-5-7-12(8-6-11)17-18-14-4-2-1-3-13(14)15(20)21/h1-8,16,19H,9-10H2,(H,20,21)
InChIKey
NVHXJLGJXFDVRP-UHFFFAOYSA-N
Compound name
2-[[4-(2-hydroxyethylamino)phenyl]diazenyl]benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.11133 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.11861 162.7
[M+Na]+ 308.10055 168.1
[M-H]- 284.10405 169.4
[M+NH4]+ 303.14515 177.0
[M+K]+ 324.07449 165.1
[M+H-H2O]+ 268.10859 153.8
[M+HCOO]- 330.10953 189.7
[M+CH3COO]- 344.12518 207.4
[M+Na-2H]- 306.08600 168.9
[M]+ 285.11078 162.8
[M]- 285.11188 162.8
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

No patent data available for this compound.