CID 43155364

1497-18-3

Structural Information

Molecular Formula
C11H10ClNO2
SMILES
CC1(CC(=O)NC1=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C11H10ClNO2/c1-11(6-9(14)13-10(11)15)7-2-4-8(12)5-3-7/h2-5H,6H2,1H3,(H,13,14,15)
InChIKey
UUGLTVQGULWIPD-UHFFFAOYSA-N
Compound name
3-(4-chlorophenyl)-3-methylpyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.04001 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.04729 145.1
[M+Na]+ 246.02923 155.5
[M-H]- 222.03273 149.8
[M+NH4]+ 241.07383 166.3
[M+K]+ 262.00317 150.1
[M+H-H2O]+ 206.03727 140.0
[M+HCOO]- 268.03821 161.9
[M+CH3COO]- 282.05386 182.8
[M+Na-2H]- 244.01468 148.5
[M]+ 223.03946 144.6
[M]- 223.04056 144.6
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.