CID 20492870

28213-81-2

Structural Information

Molecular Formula

C₁₇H₂₂N₂

SMILES

CN(C)C1=CC=CC=C1CC2=CC=CC=C2N(C)C

InChI

InChI=1S/C17H22N2/c1-18(2)16-11-7-5-9-14(16)13-15-10-6-8-12-17(15)19(3)4/h5-12H,13H2,1-4H3

InChIKey

DTNQFFYVOVIRFQ-UHFFFAOYSA-N

Compound name

2-[[2-(dimethylamino)phenyl]methyl]-N,N-dimethylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 100
Patents: 254.1783 Da
Monoisotopic Mass: 4.1
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]+	255.185576	161.6
[M+Na]+	277.167518	167.3
[M-H]-	253.171024	170.9
[M+NH4]+	272.212123	179.4
[M+K]+	293.141458	165.4
[M+H-H2O]+	237.175560	153.0
[M+HCOO]-	299.176501	188.0
[M+CH3COO]-	313.192151	210.0
[M+Na-2H]-	275.152966	165.8
[M]+	254.17775142	163.6
[M]-	254.17884858	163.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe