CID 115966

Morpholinylacetylurea, hydrochloride

Structural Information

Molecular Formula

C₇H₁₃N₃O₃

SMILES

C1COCCN1CC(=O)NC(=O)N

InChI

InChI=1S/C7H13N3O3/c8-7(12)9-6(11)5-10-1-3-13-4-2-10/h1-5H2,(H3,8,9,11,12)

InChIKey

SJXZNTKSMKJPAG-UHFFFAOYSA-N

Compound name

N-carbamoyl-2-morpholin-4-ylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 187.09569 Da
Monoisotopic Mass: -1.0
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]+	188.10297	141.3
[M+Na]+	210.08491	144.8
[M-H]-	186.08841	142.7
[M+NH4]+	205.12951	156.8
[M+K]+	226.05885	145.6
[M+H-H2O]+	170.09295	133.8
[M+HCOO]-	232.09389	160.4
[M+CH3COO]-	246.10954	183.3
[M+Na-2H]-	208.07036	145.5
[M]+	187.09514	136.2
[M]-	187.09624	136.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe