CID 114081

5-(p-acetamidophenylazo)-8-quinolinol hydrochloride

Structural Information

Molecular Formula
C17H14N4O2
SMILES
CC(=O)NC1=CC=C(C=C1)N=NC2=C3C=CC=NC3=C(C=C2)O
InChI
InChI=1S/C17H14N4O2/c1-11(22)19-12-4-6-13(7-5-12)20-21-15-8-9-16(23)17-14(15)3-2-10-18-17/h2-10,23H,1H3,(H,19,22)
InChIKey
DKRPSSOODLBKPQ-UHFFFAOYSA-N
Compound name
N-[4-[(8-hydroxyquinolin-5-yl)diazenyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

306.11166 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.11894 168.4
[M+Na]+ 329.10088 175.8
[M-H]- 305.10438 176.4
[M+NH4]+ 324.14548 182.5
[M+K]+ 345.07482 171.8
[M+H-H2O]+ 289.10892 158.5
[M+HCOO]- 351.10986 194.5
[M+CH3COO]- 365.12551 214.6
[M+Na-2H]- 327.08633 176.9
[M]+ 306.11111 169.4
[M]- 306.11221 169.4
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