CID 76378

Einecs 221-136-9

Structural Information

Molecular Formula
C18H23N3O
SMILES
CCN(CC)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCC
InChI
InChI=1S/C18H23N3O/c1-4-21(5-2)17-11-7-15(8-12-17)19-20-16-9-13-18(14-10-16)22-6-3/h7-14H,4-6H2,1-3H3
InChIKey
AYKNBEUSHQHYSX-UHFFFAOYSA-N
Compound name
4-[(4-ethoxyphenyl)diazenyl]-N,N-diethylaniline
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

287
Patents

297.1841 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.191376 172.2
[M+Na]+ 320.173318 177.5
[M-H]- 296.176824 182.5
[M+NH4]+ 315.217923 188.4
[M+K]+ 336.147258 175.7
[M+H-H2O]+ 280.181360 162.2
[M+HCOO]- 342.182301 202.0
[M+CH3COO]- 356.197951 220.2
[M+Na-2H]- 318.158766 177.8
[M]+ 297.18355142 176.8
[M]- 297.18464858 176.8
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