CID 106009

67893-45-2

Structural Information

Molecular Formula
C16H14N4O4S
SMILES
C1=CC(=CC=C1N)N=NC2=C(C=C3C=CC(=CC3=C2O)N)S(=O)(=O)O
InChI
InChI=1S/C16H14N4O4S/c17-10-3-5-12(6-4-10)19-20-15-14(25(22,23)24)7-9-1-2-11(18)8-13(9)16(15)21/h1-8,21H,17-18H2,(H,22,23,24)
InChIKey
ZCVNCZPTVCNNOD-UHFFFAOYSA-N
Compound name
6-amino-3-[(4-aminophenyl)diazenyl]-4-hydroxynaphthalene-2-sulfonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

358.07358 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.08086 178.2
[M+Na]+ 381.06280 188.8
[M+NH4]+ 376.10740 184.2
[M+K]+ 397.03674 182.3
[M-H]- 357.06630 182.9
[M+Na-2H]- 379.04825 185.0
[M]+ 358.07303 181.2
[M]- 358.07413 181.2
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