CID 29921664

Methyl 6-(aminomethyl)picolinate

Structural Information

Molecular Formula

C₈H₁₀N₂O₂

SMILES

COC(=O)C1=CC=CC(=N1)CN

InChI

InChI=1S/C8H10N2O2/c1-12-8(11)7-4-2-3-6(5-9)10-7/h2-4H,5,9H2,1H3

InChIKey

BXSRCFBJJKYNGE-UHFFFAOYSA-N

Compound name

methyl 6-(aminomethyl)pyridine-2-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 166.07423 Da
Monoisotopic Mass: -0.1
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]+	167.08151	133.9
[M+Na]+	189.06345	145.5
[M+NH4]+	184.10805	141.3
[M+K]+	205.03739	140.4
[M-H]-	165.06695	135.2
[M+Na-2H]-	187.04890	140.1
[M]+	166.07368	135.7
[M]-	166.07478	135.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe