CID 134128969

2140326-92-5

Structural Information

Molecular Formula

C₁₀H₁₀N₂O₃

SMILES

CCOC(=O)COC1=C(C=CC=N1)C#N

InChI

InChI=1S/C10H10N2O3/c1-2-14-9(13)7-15-10-8(6-11)4-3-5-12-10/h3-5H,2,7H2,1H3

InChIKey

NHXMNCLGAIALLI-UHFFFAOYSA-N

Compound name

ethyl 2-[(3-cyano-2-pyridinyl)oxy]acetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 206.06914 Da
Monoisotopic Mass: 1.2
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]+	207.076416	141.3
[M+Na]+	229.058358	150.8
[M-H]-	205.061864	143.0
[M+NH4]+	224.102963	156.9
[M+K]+	245.032298	149.2
[M+H-H2O]+	189.066400	127.6
[M+HCOO]-	251.067341	160.5
[M+CH3COO]-	265.082991	196.6
[M+Na-2H]-	227.043806	146.8
[M]+	206.06859142	139.7
[M]-	206.06968858	139.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.