CID 18187

3',4'-dimethyl-4-(dimethylamino)azobenzene

Structural Information

Molecular Formula
C16H19N3
SMILES
CC1=C(C=C(C=C1)N=NC2=CC=C(C=C2)N(C)C)C
InChI
InChI=1S/C16H19N3/c1-12-5-6-15(11-13(12)2)18-17-14-7-9-16(10-8-14)19(3)4/h5-11H,1-4H3
InChIKey
ILUWGGAOQJAFCM-UHFFFAOYSA-N
Compound name
4-[(3,4-dimethylphenyl)diazenyl]-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.1579 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.16518 159.7
[M+Na]+ 276.14712 167.1
[M-H]- 252.15062 170.9
[M+NH4]+ 271.19172 178.3
[M+K]+ 292.12106 165.2
[M+H-H2O]+ 236.15516 150.7
[M+HCOO]- 298.15610 190.1
[M+CH3COO]- 312.17175 213.3
[M+Na-2H]- 274.13257 165.7
[M]+ 253.15735 162.8
[M]- 253.15845 162.8
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

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