CID 116781

Einecs 274-732-6

Structural Information

Molecular Formula
C20H17N3O2
SMILES
CC(=O)NC1=CC=C(C=C1)N=NC2=C(C=CC(=C2)C3=CC=CC=C3)O
InChI
InChI=1S/C20H17N3O2/c1-14(24)21-17-8-10-18(11-9-17)22-23-19-13-16(7-12-20(19)25)15-5-3-2-4-6-15/h2-13,25H,1H3,(H,21,24)
InChIKey
HMDMKWUYPKVKNM-UHFFFAOYSA-N
Compound name
N-[4-[(2-hydroxy-5-phenylphenyl)diazenyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

331.13208 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.139356 177.6
[M+Na]+ 354.121298 183.6
[M-H]- 330.124804 188.8
[M+NH4]+ 349.165903 190.6
[M+K]+ 370.095238 179.2
[M+H-H2O]+ 314.129340 167.2
[M+HCOO]- 376.130281 205.4
[M+CH3COO]- 390.145931 219.1
[M+Na-2H]- 352.106746 183.3
[M]+ 331.13153142 177.6
[M]- 331.13262858 177.6
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.