CID 3877343

60869-69-4

Structural Information

Molecular Formula

C₁₁H₁₆N₃

SMILES

CCN(CC)C1=CC(=C(C=C1)[N+]#N)C

InChI

InChI=1S/C11H16N3/c1-4-14(5-2)10-6-7-11(13-12)9(3)8-10/h6-8H,4-5H2,1-3H3/q+1

InChIKey

WNOOXEGVVSEFOS-UHFFFAOYSA-N

Compound name

4-(diethylamino)-2-methylbenzenediazonium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 31
Patents: 190.13443 Da
Monoisotopic Mass: 3.8
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]+	191.14171	144.9
[M+Na]+	213.12365	153.9
[M-H]-	189.12715	150.8
[M+NH4]+	208.16825	163.2
[M+K]+	229.09759	147.9
[M+H-H2O]+	173.13169	134.2
[M+HCOO]-	235.13263	168.3
[M+CH3COO]-	249.14828	201.5
[M+Na-2H]-	211.10910	152.1
[M]+	190.13388	141.3
[M]-	190.13498	141.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe