CID 62562

C.i. solvent red 2

Structural Information

Molecular Formula
C17H14N2O
SMILES
CC1=CC=CC=C1N=NC2=CC=C(C3=CC=CC=C32)O
InChI
InChI=1S/C17H14N2O/c1-12-6-2-5-9-15(12)18-19-16-10-11-17(20)14-8-4-3-7-13(14)16/h2-11,20H,1H3
InChIKey
PYFMJAMMVDSYFT-UHFFFAOYSA-N
Compound name
4-[(2-methylphenyl)diazenyl]naphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

159
Patents

262.11063 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.117906 157.9
[M+Na]+ 285.099848 166.5
[M-H]- 261.103354 167.3
[M+NH4]+ 280.144453 175.8
[M+K]+ 301.073788 162.0
[M+H-H2O]+ 245.107890 149.3
[M+HCOO]- 307.108831 185.0
[M+CH3COO]- 321.124481 171.1
[M+Na-2H]- 283.085296 166.7
[M]+ 262.11008142 159.0
[M]- 262.11117858 159.0
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