CID 99294

3-amino-n,n-dimethylbenzylamine

Structural Information

Molecular Formula

C₉H₁₄N₂

SMILES

CN(C)CC1=CC(=CC=C1)N

InChI

InChI=1S/C9H14N2/c1-11(2)7-8-4-3-5-9(10)6-8/h3-6H,7,10H2,1-2H3

InChIKey

WOJBIBHVUSZAGS-UHFFFAOYSA-N

Compound name

3-[(dimethylamino)methyl]aniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 510
Patents: 150.11569 Da
Monoisotopic Mass: 0.7
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]+	151.12297	132.4
[M+Na]+	173.10491	144.2
[M+NH4]+	168.14951	141.8
[M+K]+	189.07885	137.8
[M-H]-	149.10841	136.6
[M+Na-2H]-	171.09036	140.2
[M]+	150.11514	135.2
[M]-	150.11624	135.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe