CID 153415

72765-52-7

Structural Information

Molecular Formula
C24H20N4O4S
SMILES
CCOC1=CC=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)N=NC4=CC(=CC=C4)S(=O)(=O)O
InChI
InChI=1S/C24H20N4O4S/c1-2-32-19-12-10-17(11-13-19)25-27-23-14-15-24(22-9-4-3-8-21(22)23)28-26-18-6-5-7-20(16-18)33(29,30)31/h3-16H,2H2,1H3,(H,29,30,31)
InChIKey
CDRDTGZOEUQSFA-UHFFFAOYSA-N
Compound name
3-[[4-[(4-ethoxyphenyl)diazenyl]naphthalen-1-yl]diazenyl]benzenesulfonic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

122
Patents

460.1205 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 461.127776 207.1
[M+Na]+ 483.109718 213.9
[M-H]- 459.113224 221.0
[M+NH4]+ 478.154323 216.9
[M+K]+ 499.083658 209.5
[M+H-H2O]+ 443.117760 195.1
[M+HCOO]- 505.118701 231.8
[M+CH3COO]- 519.134351 245.7
[M+Na-2H]- 481.095166 215.7
[M]+ 460.11995142 213.7
[M]- 460.12104858 213.7
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

patents stripe