CID 131856609

Iprodione tp2

Structural Information

Molecular Formula
C11H13Cl2N3O2
SMILES
CC(C)NC(=O)NC(=O)NC1=CC(=CC(=C1)Cl)Cl
InChI
InChI=1S/C11H13Cl2N3O2/c1-6(2)14-10(17)16-11(18)15-9-4-7(12)3-8(13)5-9/h3-6H,1-2H3,(H3,14,15,16,17,18)
InChIKey
MLYSJLQSYCTSDE-UHFFFAOYSA-N
Compound name
1-(3,5-dichlorophenyl)-3-(propan-2-ylcarbamoyl)urea
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

289.03848 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.04576 164.0
[M+Na]+ 312.02770 171.0
[M-H]- 288.03120 167.4
[M+NH4]+ 307.07230 180.4
[M+K]+ 328.00164 166.6
[M+H-H2O]+ 272.03574 159.4
[M+HCOO]- 334.03668 179.4
[M+CH3COO]- 348.05233 205.2
[M+Na-2H]- 310.01315 165.5
[M]+ 289.03793 165.9
[M]- 289.03903 165.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.