CID 4156306

4-(decyloxy)azobenzene

Structural Information

Molecular Formula
C22H30N2O
SMILES
CCCCCCCCCCOC1=CC=C(C=C1)N=NC2=CC=CC=C2
InChI
InChI=1S/C22H30N2O/c1-2-3-4-5-6-7-8-12-19-25-22-17-15-21(16-18-22)24-23-20-13-10-9-11-14-20/h9-11,13-18H,2-8,12,19H2,1H3
InChIKey
LOUSASKCRIPPDT-UHFFFAOYSA-N
Compound name
(4-decoxyphenyl)-phenyldiazene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

338.2358 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.243076 185.7
[M+Na]+ 361.225018 189.0
[M-H]- 337.228524 193.3
[M+NH4]+ 356.269623 199.6
[M+K]+ 377.198958 184.8
[M+H-H2O]+ 321.233060 175.2
[M+HCOO]- 383.234001 212.7
[M+CH3COO]- 397.249651 222.6
[M+Na-2H]- 359.210466 190.2
[M]+ 338.23525142 190.7
[M]- 338.23634858 190.7
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