CID 89471

Ethanimidic acid, n-methoxy-, ethyl ester

Structural Information

Molecular Formula

C₅H₁₁NO₂

SMILES

CCOC(=NOC)C

InChI

InChI=1S/C5H11NO2/c1-4-8-5(2)6-7-3/h4H2,1-3H3

InChIKey

NZYMDDNXBAMPRN-UHFFFAOYSA-N

Compound name

ethyl N-methoxyethanimidate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 117.07898 Da
Monoisotopic Mass: 1.1
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]+	118.08626	123.2
[M+Na]+	140.06820	133.1
[M+NH4]+	135.11280	131.1
[M+K]+	156.04214	128.2
[M-H]-	116.07170	123.2
[M+Na-2H]-	138.05365	127.5
[M]+	117.07843	124.3
[M]-	117.07953	124.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe