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]+ 401.23360 200.1
[M+Na]+ 423.21554 204.7
[M-H]- 399.21904 214.0
[M+NH4]+ 418.26014 212.0
[M+K]+ 439.18948 200.5
[M+H-H2O]+ 383.22358 187.2
[M+HCOO]- 445.22452 232.3
[M+CH3COO]- 459.24017 243.0
[M+Na-2H]- 421.20099 205.9
[M]+ 400.22577 205.6
[M]- 400.22687 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