CID 4614663

Ethyl 6-methyl-3-pyridyloxyacetate

Structural Information

Molecular Formula

C₁₀H₁₃NO₃

SMILES

CCOC(=O)COC1=CN=C(C=C1)C

InChI

InChI=1S/C10H13NO3/c1-3-13-10(12)7-14-9-5-4-8(2)11-6-9/h4-6H,3,7H2,1-2H3

InChIKey

SLQPGPDBDCSQMM-UHFFFAOYSA-N

Compound name

ethyl 2-(6-methylpyridin-3-yl)oxyacetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 53
Patents: 195.08954 Da
Monoisotopic Mass: 1.5
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]+	196.09682	141.7
[M+Na]+	218.07876	154.0
[M+NH4]+	213.12336	148.9
[M+K]+	234.05270	148.4
[M-H]-	194.08226	142.3
[M+Na-2H]-	216.06421	147.7
[M]+	195.08899	143.5
[M]-	195.09009	143.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe