CID 222535

Ethyl hydantoate

Structural Information

Molecular Formula

C₅H₁₀N₂O₃

SMILES

CCOC(=O)CNC(=O)N

InChI

InChI=1S/C5H10N2O3/c1-2-10-4(8)3-7-5(6)9/h2-3H2,1H3,(H3,6,7,9)

InChIKey

YKPKXMAVLXBQDT-UHFFFAOYSA-N

Compound name

ethyl 2-(carbamoylamino)acetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 105
Patents: 146.06914 Da
Monoisotopic Mass: -0.9
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]+	147.076416	129.7
[M+Na]+	169.058358	135.8
[M-H]-	145.061864	129.7
[M+NH4]+	164.102963	150.1
[M+K]+	185.032298	136.5
[M+H-H2O]+	129.066400	124.2
[M+HCOO]-	191.067341	154.4
[M+CH3COO]-	205.082991	177.8
[M+Na-2H]-	167.043806	134.0
[M]+	146.06859142	129.3
[M]-	146.06968858	129.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe