CID 135429812

6300-34-1

Structural Information

Molecular Formula
C18H16N4O3
SMILES
CN(C)C(=O)C1=CC=C(C=C1)N=NC2=C(C3=CC=CC=C3NC2=O)O
InChI
InChI=1S/C18H16N4O3/c1-22(2)18(25)11-7-9-12(10-8-11)20-21-15-16(23)13-5-3-4-6-14(13)19-17(15)24/h3-10H,1-2H3,(H2,19,23,24)
InChIKey
SPTQSDYRXKGNOC-UHFFFAOYSA-N
Compound name
4-[(4-hydroxy-2-oxo-1H-quinolin-3-yl)diazenyl]-N,N-dimethylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

336.12225 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.12953 176.3
[M+Na]+ 359.11147 183.9
[M-H]- 335.11497 184.5
[M+NH4]+ 354.15607 189.2
[M+K]+ 375.08541 180.5
[M+H-H2O]+ 319.11951 166.4
[M+HCOO]- 381.12045 201.3
[M+CH3COO]- 395.13610 221.4
[M+Na-2H]- 357.09692 182.4
[M]+ 336.12170 178.1
[M]- 336.12280 178.1
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

No patent data available for this compound.