CID 437497

19056-34-9

Structural Information

Molecular Formula

C₁₀H₁₆N₂

SMILES

CCN(CC)C1=CC=CC=C1N

InChI

InChI=1S/C10H16N2/c1-3-12(4-2)10-8-6-5-7-9(10)11/h5-8H,3-4,11H2,1-2H3

InChIKey

YNAKESQZGPZDDZ-UHFFFAOYSA-N

Compound name

2-N,2-N-diethylbenzene-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 429
Patents: 164.13135 Da
Monoisotopic Mass: 2.1
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]+	165.13863	136.9
[M+Na]+	187.12057	143.3
[M-H]-	163.12407	141.5
[M+NH4]+	182.16517	157.7
[M+K]+	203.09451	142.1
[M+H-H2O]+	147.12861	130.5
[M+HCOO]-	209.12955	163.1
[M+CH3COO]-	223.14520	188.0
[M+Na-2H]-	185.10602	142.6
[M]+	164.13080	136.3
[M]-	164.13190	136.3

Literature stripe

literature stripe

Patent stripe

patents stripe