CID 93874

58669-30-0

Structural Information

Molecular Formula

C₉H₁₄N₂

SMILES

CC(C)NCC1=CC=CC=N1

InChI

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

InChIKey

YDCNZMOBAPTYRB-UHFFFAOYSA-N

Compound name

N-(pyridin-2-ylmethyl)propan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 604
Patents: 150.11569 Da
Monoisotopic Mass: 1.1
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]+	151.12297	133.0
[M+Na]+	173.10491	145.1
[M+NH4]+	168.14951	141.8
[M+K]+	189.07885	138.4
[M-H]-	149.10841	135.6
[M+Na-2H]-	171.09036	140.7
[M]+	150.11514	135.3
[M]-	150.11624	135.3

Literature stripe

literature stripe

Patent stripe

patents stripe