CID 209450

Urea, 1-allyl-3-(p-chlorobenzenesulfonyl)-

Structural Information

Molecular Formula
C10H11ClN2O3S
SMILES
C=CCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)Cl
InChI
InChI=1S/C10H11ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h2-6H,1,7H2,(H2,12,13,14)
InChIKey
XOJOKGIJLOFQKV-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)sulfonyl-3-prop-2-enylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.01788 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.02516 159.1
[M+Na]+ 297.00710 168.7
[M+NH4]+ 292.05170 165.4
[M+K]+ 312.98104 161.7
[M-H]- 273.01060 159.6
[M+Na-2H]- 294.99255 163.6
[M]+ 274.01733 161.0
[M]- 274.01843 161.0
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.