CID 21043

4-(diethylamino)-4'-ethylazobenzene

Structural Information

Molecular Formula
C18H23N3
SMILES
CCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(CC)CC
InChI
InChI=1S/C18H23N3/c1-4-15-7-9-16(10-8-15)19-20-17-11-13-18(14-12-17)21(5-2)6-3/h7-14H,4-6H2,1-3H3
InChIKey
PQPOCSPPXRINCI-UHFFFAOYSA-N
Compound name
N,N-diethyl-4-[(4-ethylphenyl)diazenyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.1892 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.19648 168.9
[M+Na]+ 304.17842 174.4
[M-H]- 280.18192 179.2
[M+NH4]+ 299.22302 185.9
[M+K]+ 320.15236 172.0
[M+H-H2O]+ 264.18646 159.2
[M+HCOO]- 326.18740 198.6
[M+CH3COO]- 340.20305 218.2
[M+Na-2H]- 302.16387 174.5
[M]+ 281.18865 172.2
[M]- 281.18975 172.2
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

No patent data available for this compound.