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]+ 163.08257 131.8
[M+Na]+ 185.06451 136.1
[M-H]- 161.06801 130.4
[M+NH4]+ 180.10911 150.0
[M+K]+ 201.03845 136.4
[M+H-H2O]+ 145.07255 125.3
[M+HCOO]- 207.07349 157.1
[M+CH3COO]- 221.08914 181.9
[M+Na-2H]- 183.04996 136.5
[M]+ 162.07474 127.2
[M]- 162.07584 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.