CID 3023151

Ns00091436

Structural Information

Molecular Formula

C₁₃H₁₉N₅

SMILES

CN1C=CN(C1N=NC2=CC=C(C=C2)N(C)C)C

InChI

InChI=1S/C13H19N5/c1-16(2)12-7-5-11(6-8-12)14-15-13-17(3)9-10-18(13)4/h5-10,13H,1-4H3

InChIKey

DGFCCASYYOGXCL-UHFFFAOYSA-N

Compound name

4-[(1,3-dimethyl-2H-imidazol-2-yl)diazenyl]-N,N-dimethylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 220
Patents: 245.16405 Da
Monoisotopic Mass: 2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	246.171326	157.1
[M+Na]+	268.153268	164.5
[M-H]-	244.156774	165.7
[M+NH4]+	263.197873	175.0
[M+K]+	284.127208	163.4
[M+H-H2O]+	228.161310	147.1
[M+HCOO]-	290.162251	185.3
[M+CH3COO]-	304.177901	209.9
[M+Na-2H]-	266.138716	161.6
[M]+	245.16350142	159.5
[M]-	245.16459858	159.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe