CID 3454676

1-allyl-3-(2,4-dichlorophenyl)urea

Structural Information

Molecular Formula
C10H10Cl2N2O
SMILES
C=CCNC(=O)NC1=C(C=C(C=C1)Cl)Cl
InChI
InChI=1S/C10H10Cl2N2O/c1-2-5-13-10(15)14-9-4-3-7(11)6-8(9)12/h2-4,6H,1,5H2,(H2,13,14,15)
InChIKey
ZEYBCZBHTADNKJ-UHFFFAOYSA-N
Compound name
1-(2,4-dichlorophenyl)-3-prop-2-enylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.01701 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.02429 150.6
[M+Na]+ 267.00623 163.1
[M+NH4]+ 262.05083 158.7
[M+K]+ 282.98017 155.5
[M-H]- 243.00973 153.1
[M+Na-2H]- 264.99168 156.9
[M]+ 244.01646 153.5
[M]- 244.01756 153.5
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.