CID 10631771

(s)-6-chloronicotine

Structural Information

Molecular Formula

C₁₀H₁₃ClN₂

SMILES

CN1CCC[C@H]1C2=CN=C(C=C2)Cl

InChI

InChI=1S/C10H13ClN2/c1-13-6-2-3-9(13)8-4-5-10(11)12-7-8/h4-5,7,9H,2-3,6H2,1H3/t9-/m0/s1

InChIKey

SVVOLGNZRGLPIU-VIFPVBQESA-N

Compound name

2-chloro-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 105
Patents: 196.07672 Da
Monoisotopic Mass: 2.1
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]+	197.08400	141.3
[M+Na]+	219.06594	155.4
[M+NH4]+	214.11054	150.8
[M+K]+	235.03988	149.3
[M-H]-	195.06944	144.7
[M+Na-2H]-	217.05139	149.1
[M]+	196.07617	144.6
[M]-	196.07727	144.6

Literature stripe

literature stripe

Patent stripe

patents stripe