CID 699522

Dtxsid201037783

Structural Information

Molecular Formula
C18H19N3O
SMILES
C1CC2=CC(=C(C3=C2N(C1)CCC3)O)N=NC4=CC=CC=C4
InChI
InChI=1S/C18H19N3O/c22-18-15-9-5-11-21-10-4-6-13(17(15)21)12-16(18)20-19-14-7-2-1-3-8-14/h1-3,7-8,12,22H,4-6,9-11H2
InChIKey
VUDVSBCKIRWZDE-UHFFFAOYSA-N
Compound name
7-phenyldiazenyl-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-trien-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

293.1528 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.16008 167.9
[M+Na]+ 316.14202 181.8
[M+NH4]+ 311.18662 177.9
[M+K]+ 332.11596 172.5
[M-H]- 292.14552 174.6
[M+Na-2H]- 314.12747 175.6
[M]+ 293.15225 171.8
[M]- 293.15335 171.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.