CID 205068

Urea, (2,4-dichlorophenethyl)-

Structural Information

Molecular Formula
C9H10Cl2N2O
SMILES
C1=CC(=C(C=C1Cl)Cl)CCNC(=O)N
InChI
InChI=1S/C9H10Cl2N2O/c10-7-2-1-6(8(11)5-7)3-4-13-9(12)14/h1-2,5H,3-4H2,(H3,12,13,14)
InChIKey
SBXKLOACRONULN-UHFFFAOYSA-N
Compound name
2-(2,4-dichlorophenyl)ethylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.01701 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.024286 148.2
[M+Na]+ 255.006228 156.9
[M-H]- 231.009734 150.9
[M+NH4]+ 250.050833 166.9
[M+K]+ 270.980168 151.4
[M+H-H2O]+ 215.014270 144.0
[M+HCOO]- 277.015211 163.9
[M+CH3COO]- 291.030861 192.5
[M+Na-2H]- 252.991676 151.8
[M]+ 232.01646142 149.5
[M]- 232.01755858 149.5
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.