CID 50681

Lolop granule

Structural Information

Molecular Formula
C11H12Cl2N2O2
SMILES
C1CCN(C1)OC(=O)NC2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C11H12Cl2N2O2/c12-8-3-4-10(9(13)7-8)14-11(16)17-15-5-1-2-6-15/h3-4,7H,1-2,5-6H2,(H,14,16)
InChIKey
FLHDOVJPDYHPPV-UHFFFAOYSA-N
Compound name
pyrrolidin-1-yl N-(2,4-dichlorophenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.0276 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.034876 159.1
[M+Na]+ 297.016818 166.9
[M-H]- 273.020324 163.5
[M+NH4]+ 292.061423 176.6
[M+K]+ 312.990758 161.9
[M+H-H2O]+ 257.024860 152.6
[M+HCOO]- 319.025801 171.8
[M+CH3COO]- 333.041451 194.4
[M+Na-2H]- 295.002266 160.6
[M]+ 274.02705142 160.0
[M]- 274.02814858 160.0
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.