CID 3059243

1-ethyl-5-phenylbiuret

Structural Information

Molecular Formula
C10H13N3O2
SMILES
CCN(C(=O)N)C(=O)NC1=CC=CC=C1
InChI
InChI=1S/C10H13N3O2/c1-2-13(9(11)14)10(15)12-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H2,11,14)(H,12,15)
InChIKey
MOSMZRVNUZIATN-UHFFFAOYSA-N
Compound name
1-carbamoyl-1-ethyl-3-phenylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.10077 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.108046 146.3
[M+Na]+ 230.089988 151.0
[M-H]- 206.093494 150.7
[M+NH4]+ 225.134593 164.4
[M+K]+ 246.063928 150.8
[M+H-H2O]+ 190.098030 138.9
[M+HCOO]- 252.098971 172.4
[M+CH3COO]- 266.114621 194.2
[M+Na-2H]- 228.075436 150.5
[M]+ 207.10022142 144.5
[M]- 207.10131858 144.5
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.