CID 163360169

68134-03-2

Structural Information

Molecular Formula
C4H10N4O3
SMILES
C(NC(=O)NC(=NCO)N)O
InChI
InChI=1S/C4H10N4O3/c5-3(6-1-9)8-4(11)7-2-10/h9-10H,1-2H2,(H4,5,6,7,8,11)
InChIKey
MOIUNPVVIGYXHA-UHFFFAOYSA-N
Compound name
1-(hydroxymethyl)-3-[N'-(hydroxymethyl)carbamimidoyl]urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

162.07529 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.082566 131.8
[M+Na]+ 185.064508 136.1
[M-H]- 161.068014 130.4
[M+NH4]+ 180.109113 150.0
[M+K]+ 201.038448 136.4
[M+H-H2O]+ 145.072550 125.3
[M+HCOO]- 207.073491 157.1
[M+CH3COO]- 221.089141 181.9
[M+Na-2H]- 183.049956 136.5
[M]+ 162.07474142 127.2
[M]- 162.07583858 127.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.