CID 353704

81199-30-6

Structural Information

Molecular Formula
C10H9ClN2O2
SMILES
C1C(C(=O)N(C1=O)N)C2=CC(=CC=C2)Cl
InChI
InChI=1S/C10H9ClN2O2/c11-7-3-1-2-6(4-7)8-5-9(14)13(12)10(8)15/h1-4,8H,5,12H2
InChIKey
XZEKJPZKBUAPIX-UHFFFAOYSA-N
Compound name
1-amino-3-(3-chlorophenyl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.03525 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.042526 146.5
[M+Na]+ 247.024468 156.8
[M-H]- 223.027974 152.1
[M+NH4]+ 242.069073 165.9
[M+K]+ 262.998408 151.9
[M+H-H2O]+ 207.032510 140.4
[M+HCOO]- 269.033451 165.3
[M+CH3COO]- 283.049101 188.3
[M+Na-2H]- 245.009916 148.2
[M]+ 224.03470142 145.9
[M]- 224.03579858 145.9
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.