CID 135596629

15525-22-1

Structural Information

Molecular Formula
C16H11N3O4
SMILES
C1=CC=C2C(=C1)C=CC(=C2O)N=NC3=C(C=C(C=C3)[N+](=O)[O-])O
InChI
InChI=1S/C16H11N3O4/c20-15-9-11(19(22)23)6-8-13(15)17-18-14-7-5-10-3-1-2-4-12(10)16(14)21/h1-9,20-21H
InChIKey
MFAHOKMOAHUZIC-UHFFFAOYSA-N
Compound name
2-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.07495 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.08223 166.7
[M+Na]+ 332.06417 181.6
[M+NH4]+ 327.10877 174.6
[M+K]+ 348.03811 176.8
[M-H]- 308.06767 173.8
[M+Na-2H]- 330.04962 175.5
[M]+ 309.07440 170.7
[M]- 309.07550 170.7
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.