CID 86673

18190-79-9

Structural Information

Molecular Formula

C₇H₁₄N₂O₅

SMILES

COCN1C(C(N(C1=O)CO)OC)O

InChI

InChI=1S/C7H14N2O5/c1-13-4-9-5(11)6(14-2)8(3-10)7(9)12/h5-6,10-11H,3-4H2,1-2H3

InChIKey

ZNLUHFSDKZRMES-UHFFFAOYSA-N

Compound name

4-hydroxy-1-(hydroxymethyl)-5-methoxy-3-(methoxymethyl)imidazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 206.09027 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]+	207.09755	141.9
[M+Na]+	229.07949	150.6
[M-H]-	205.08299	140.6
[M+NH4]+	224.12409	159.1
[M+K]+	245.05343	149.9
[M+H-H2O]+	189.08753	135.9
[M+HCOO]-	251.08847	160.4
[M+CH3COO]-	265.10412	180.8
[M+Na-2H]-	227.06494	143.3
[M]+	206.08972	144.2
[M]-	206.09082	144.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe