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
2
Annotation Hits

0
References

236
Patents

297.1841 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.19138 172.2
[M+Na]+ 320.17332 177.5
[M-H]- 296.17682 182.5
[M+NH4]+ 315.21792 188.4
[M+K]+ 336.14726 175.7
[M+H-H2O]+ 280.18136 162.2
[M+HCOO]- 342.18230 202.1
[M+CH3COO]- 356.19795 220.2
[M+Na-2H]- 318.15877 177.8
[M]+ 297.18355 176.8
[M]- 297.18465 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