CID 316542

N-ethylglycine

Structural Information

Molecular Formula

SMILES

CCNCC(=O)O

InChI

InChI=1S/C4H9NO2/c1-2-5-3-4(6)7/h5H,2-3H2,1H3,(H,6,7)

InChIKey

YPIGGYHFMKJNKV-UHFFFAOYSA-N

Compound name

2-(ethylamino)acetic acid

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 12
References: 12560
Patents: 103.06333 Da
Monoisotopic Mass: -2.8
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]+	104.07061	119.3
[M+Na]+	126.05255	128.2
[M+NH4]+	121.09715	126.6
[M+K]+	142.02649	124.2
[M-H]-	102.05605	118.2
[M+Na-2H]-	124.03800	122.6
[M]+	103.06278	119.8
[M]-	103.06388	119.8

Literature stripe

literature stripe

Patent stripe

patents stripe