CID 136086329

94023-26-4

Structural Information

Molecular Formula
C19H16N4O4
SMILES
C1C(CNC2=C3C=CC=C(C3=C(C=C21)N=NC4=CC=C(C=C4)[N+](=O)[O-])O)O
InChI
InChI=1S/C19H16N4O4/c24-14-8-11-9-16(22-21-12-4-6-13(7-5-12)23(26)27)18-15(19(11)20-10-14)2-1-3-17(18)25/h1-7,9,14,20,24-25H,8,10H2
InChIKey
WVJOJDCLAFKLPC-UHFFFAOYSA-N
Compound name
6-[(4-nitrophenyl)diazenyl]-1,2,3,4-tetrahydrobenzo[h]quinoline-3,7-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.11716 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.124436 176.3
[M+Na]+ 387.106378 181.0
[M-H]- 363.109884 181.7
[M+NH4]+ 382.150983 186.6
[M+K]+ 403.080318 171.7
[M+H-H2O]+ 347.114420 170.7
[M+HCOO]- 409.115361 195.8
[M+CH3COO]- 423.131011 213.8
[M+Na-2H]- 385.091826 185.6
[M]+ 364.11661142 171.7
[M]- 364.11770858 171.7
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.