CID 18071209

1016688-73-5

Structural Information

Molecular Formula

C₁₀H₁₅ClN₂

SMILES

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

InChI

InChI=1S/C10H15ClN2/c1-8(2)13(3)7-9-4-5-10(11)12-6-9/h4-6,8H,7H2,1-3H3

InChIKey

KVXNMJUYGSKIKB-UHFFFAOYSA-N

Compound name

N-[(6-chloropyridin-3-yl)methyl]-N-methylpropan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 198.09238 Da
Monoisotopic Mass: 2.4
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]+	199.09966	142.6
[M+Na]+	221.08160	156.0
[M+NH4]+	216.12620	151.8
[M+K]+	237.05554	148.9
[M-H]-	197.08510	145.6
[M+Na-2H]-	219.06705	150.2
[M]+	198.09183	145.7
[M]-	198.09293	145.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe