CID 584035

4-azido-n,n-dimethylaniline

Structural Information

Molecular Formula

C₈H₁₀N₄

SMILES

CN(C)C1=CC=C(C=C1)N=[N+]=[N-]

InChI

InChI=1S/C8H10N4/c1-12(2)8-5-3-7(4-6-8)10-11-9/h3-6H,1-2H3

InChIKey

BKQJWJKRVJLLFK-UHFFFAOYSA-N

Compound name

4-azido-N,N-dimethylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 26
Patents: 162.09055 Da
Monoisotopic Mass: 3.1
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]+	163.09783	132.8
[M+Na]+	185.07977	145.8
[M+NH4]+	180.12437	142.4
[M+K]+	201.05371	140.6
[M-H]-	161.08327	139.8
[M+Na-2H]-	183.06522	142.0
[M]+	162.09000	136.5
[M]-	162.09110	136.5

Literature stripe

literature stripe

Patent stripe

patents stripe