CID 21348957

Wf8nwa83re

Structural Information

Molecular Formula
C25H28N4O
SMILES
CCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)OCCC
InChI
InChI=1S/C25H28N4O/c1-3-5-6-20-7-9-21(10-8-20)26-27-22-11-13-23(14-12-22)28-29-24-15-17-25(18-16-24)30-19-4-2/h7-18H,3-6,19H2,1-2H3
InChIKey
ZUGKFNYCFBDWIO-UHFFFAOYSA-N
Compound name
(4-butylphenyl)-[4-[(4-propoxyphenyl)diazenyl]phenyl]diazene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

62
Patents

400.22632 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.233596 200.1
[M+Na]+ 423.215538 204.7
[M-H]- 399.219044 214.0
[M+NH4]+ 418.260143 212.0
[M+K]+ 439.189478 200.5
[M+H-H2O]+ 383.223580 187.2
[M+HCOO]- 445.224521 232.3
[M+CH3COO]- 459.240171 243.0
[M+Na-2H]- 421.200986 205.9
[M]+ 400.22577142 205.6
[M]- 400.22686858 205.6
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

patents stripe