CID 80853

6410-13-5

Structural Information

Molecular Formula
C16H10ClN3O3
SMILES
C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C=C3)Cl)[N+](=O)[O-])O
InChI
InChI=1S/C16H10ClN3O3/c17-11-6-7-13(14(9-11)20(22)23)18-19-16-12-4-2-1-3-10(12)5-8-15(16)21/h1-9,21H
InChIKey
FHEFMHNVEBIQDW-UHFFFAOYSA-N
Compound name
1-[(4-chloro-2-nitrophenyl)diazenyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

78
Patents

327.04108 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.04836 169.8
[M+Na]+ 350.03030 186.6
[M+NH4]+ 345.07490 178.9
[M+K]+ 366.00424 180.0
[M-H]- 326.03380 178.0
[M+Na-2H]- 348.01575 179.7
[M]+ 327.04053 174.9
[M]- 327.04163 174.9
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