CID 87277

Urea, n-(hydroxymethyl)-n'-(methoxymethyl)-

Structural Information

Molecular Formula

C₄H₁₀N₂O₃

SMILES

COCNC(=O)NCO

InChI

InChI=1S/C4H10N2O3/c1-9-3-6-4(8)5-2-7/h7H,2-3H2,1H3,(H2,5,6,8)

InChIKey

DATBHDRXGLZCHA-UHFFFAOYSA-N

Compound name

1-(hydroxymethyl)-3-(methoxymethyl)urea

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 3
Patents: 134.06914 Da
Monoisotopic Mass: -1.3
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]+	135.076416	125.9
[M+Na]+	157.058358	131.8
[M-H]-	133.061864	125.0
[M+NH4]+	152.102963	146.4
[M+K]+	173.032298	132.3
[M+H-H2O]+	117.066400	120.6
[M+HCOO]-	179.067341	150.7
[M+CH3COO]-	193.082991	172.9
[M+Na-2H]-	155.043806	132.6
[M]+	134.06859142	125.6
[M]-	134.06968858	125.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe