CID 67974545

Ethyl 6-vinylpicolinate

Structural Information

Molecular Formula

C₁₀H₁₁NO₂

SMILES

CCOC(=O)C1=CC=CC(=N1)C=C

InChI

InChI=1S/C10H11NO2/c1-3-8-6-5-7-9(11-8)10(12)13-4-2/h3,5-7H,1,4H2,2H3

InChIKey

BNRPBIQKLIZKRU-UHFFFAOYSA-N

Compound name

ethyl 6-ethenylpyridine-2-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 28
Patents: 177.07898 Da
Monoisotopic Mass: 2.2
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]+	178.086256	136.4
[M+Na]+	200.068198	144.8
[M-H]-	176.071704	138.9
[M+NH4]+	195.112803	155.4
[M+K]+	216.042138	142.9
[M+H-H2O]+	160.076240	129.9
[M+HCOO]-	222.077181	159.3
[M+CH3COO]-	236.092831	180.5
[M+Na-2H]-	198.053646	142.4
[M]+	177.07843142	138.4
[M]-	177.07952858	138.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe