CID 13197666

115084-81-6

Structural Information

Molecular Formula
C8H13NO2
SMILES
CC(C)C1C(=O)CC(=O)N1C
InChI
InChI=1S/C8H13NO2/c1-5(2)8-6(10)4-7(11)9(8)3/h5,8H,4H2,1-3H3
InChIKey
JWYRWJZQVPLMKQ-UHFFFAOYSA-N
Compound name
1-methyl-5-propan-2-ylpyrrolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

155.09464 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.10192 134.0
[M+Na]+ 178.08386 144.0
[M+NH4]+ 173.12846 141.3
[M+K]+ 194.05780 141.3
[M-H]- 154.08736 133.7
[M+Na-2H]- 176.06931 136.6
[M]+ 155.09409 135.0
[M]- 155.09519 135.0
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

patents stripe