CID 315310

Cb 1739

Structural Information

Molecular Formula
C15H17Cl2N3O2
SMILES
C1CC2(C3=C1C=CC(=C3)N(CCCl)CCCl)C(=O)NC(=O)N2
InChI
InChI=1S/C15H17Cl2N3O2/c16-5-7-20(8-6-17)11-2-1-10-3-4-15(12(10)9-11)13(21)18-14(22)19-15/h1-2,9H,3-8H2,(H2,18,19,21,22)
InChIKey
SLOOKLJYJCGNRB-UHFFFAOYSA-N
Compound name
5-[bis(2-chloroethyl)amino]spiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.0698 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.077076 178.1
[M+Na]+ 364.059018 186.5
[M-H]- 340.062524 180.0
[M+NH4]+ 359.103623 196.0
[M+K]+ 380.032958 179.1
[M+H-H2O]+ 324.067060 171.8
[M+HCOO]- 386.068001 186.0
[M+CH3COO]- 400.083651 187.5
[M+Na-2H]- 362.044466 177.5
[M]+ 341.06925142 178.1
[M]- 341.07034858 178.1
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.