CID 17204

4-(diethylamino)azobenzene

Structural Information

Molecular Formula
C16H19N3
SMILES
CCN(CC)C1=CC=C(C=C1)N=NC2=CC=CC=C2
InChI
InChI=1S/C16H19N3/c1-3-19(4-2)16-12-10-15(11-13-16)18-17-14-8-6-5-7-9-14/h5-13H,3-4H2,1-2H3
InChIKey
SJJISKLXUJVZOA-UHFFFAOYSA-N
Compound name
N,N-diethyl-4-phenyldiazenylaniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

44
References

1437
Patents

253.1579 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.16518 159.4
[M+Na]+ 276.14712 164.8
[M-H]- 252.15062 169.7
[M+NH4]+ 271.19172 177.3
[M+K]+ 292.12106 162.9
[M+H-H2O]+ 236.15516 149.9
[M+HCOO]- 298.15610 189.8
[M+CH3COO]- 312.17175 211.0
[M+Na-2H]- 274.13257 166.9
[M]+ 253.15735 161.6
[M]- 253.15845 161.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe