CID 136086488

Einecs 286-926-8

Structural Information

Molecular Formula
C17H16N3O
SMILES
CC[N+]1=CC=CC(=C1)N=NC2=C(C=CC3=CC=CC=C32)O
InChI
InChI=1S/C17H15N3O/c1-2-20-11-5-7-14(12-20)18-19-17-15-8-4-3-6-13(15)9-10-16(17)21/h3-12H,2H2,1H3/p+1
InChIKey
ZNYSGBCTGHUFBE-UHFFFAOYSA-O
Compound name
1-[(1-ethylpyridin-1-ium-3-yl)diazenyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.12933 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.13661 162.1
[M+Na]+ 301.11855 180.0
[M+NH4]+ 296.16315 172.4
[M+K]+ 317.09249 171.2
[M-H]- 277.12205 170.7
[M+Na-2H]- 299.10400 173.9
[M]+ 278.12878 167.6
[M]- 278.12988 167.6
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.