CID 227783

1137-80-0

Structural Information

Molecular Formula

C₁₃H₁₄N₂

SMILES

CN(C)C1=CC=C(C=C1)C2=CC=NC=C2

InChI

InChI=1S/C13H14N2/c1-15(2)13-5-3-11(4-6-13)12-7-9-14-10-8-12/h3-10H,1-2H3

InChIKey

JJCFKNYYQZDTMT-UHFFFAOYSA-N

Compound name

N,N-dimethyl-4-pyridin-4-ylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 37
Patents: 198.11569 Da
Monoisotopic Mass: 2.7
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]+	199.12297	144.2
[M+Na]+	221.10491	159.5
[M+NH4]+	216.14951	154.0
[M+K]+	237.07885	151.3
[M-H]-	197.10841	150.2
[M+Na-2H]-	219.09036	155.5
[M]+	198.11514	148.2
[M]-	198.11624	148.2

Literature stripe

literature stripe

Patent stripe

patents stripe