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

137
Patents

262.11063 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.11791 157.9
[M+Na]+ 285.09985 166.5
[M-H]- 261.10335 167.3
[M+NH4]+ 280.14445 175.8
[M+K]+ 301.07379 162.0
[M+H-H2O]+ 245.10789 149.3
[M+HCOO]- 307.10883 185.0
[M+CH3COO]- 321.12448 171.1
[M+Na-2H]- 283.08530 166.7
[M]+ 262.11008 159.0
[M]- 262.11118 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