CID 3033868

2-naphthalenol, 1-[2-[4-[2-(dimethylphenyl)diazenyl]dimethylphenyl]diazenyl]-

Structural Information

Molecular Formula
C26H24N4O
SMILES
CC1=C(C(=CC=C1)N=NC2=C(C(=C(C=C2)N=NC3=C(C=CC4=CC=CC=C43)O)C)C)C
InChI
InChI=1S/C26H24N4O/c1-16-8-7-11-22(17(16)2)27-28-23-13-14-24(19(4)18(23)3)29-30-26-21-10-6-5-9-20(21)12-15-25(26)31/h5-15,31H,1-4H3
InChIKey
KBQLHHZOZSGQGO-UHFFFAOYSA-N
Compound name
1-[[4-[(2,3-dimethylphenyl)diazenyl]-2,3-dimethylphenyl]diazenyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

562
References

70
Patents

408.195 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.20228 204.5
[M+Na]+ 431.18422 221.5
[M+NH4]+ 426.22882 213.3
[M+K]+ 447.15816 210.0
[M-H]- 407.18772 216.0
[M+Na-2H]- 429.16967 216.4
[M]+ 408.19445 210.5
[M]- 408.19555 210.5
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

patents stripe