CID 43636065

1-(propan-2-yl)-3-(propylamino)pyrrolidine-2,5-dione

Structural Information

Molecular Formula
C10H18N2O2
SMILES
CCCNC1CC(=O)N(C1=O)C(C)C
InChI
InChI=1S/C10H18N2O2/c1-4-5-11-8-6-9(13)12(7(2)3)10(8)14/h7-8,11H,4-6H2,1-3H3
InChIKey
GFKQJIZVNYZKGS-UHFFFAOYSA-N
Compound name
1-propan-2-yl-3-(propylamino)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.13683 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.14411 145.5
[M+Na]+ 221.12605 152.4
[M-H]- 197.12955 147.7
[M+NH4]+ 216.17065 165.4
[M+K]+ 237.09999 151.0
[M+H-H2O]+ 181.13409 139.4
[M+HCOO]- 243.13503 167.0
[M+CH3COO]- 257.15068 189.3
[M+Na-2H]- 219.11150 146.0
[M]+ 198.13628 145.3
[M]- 198.13738 145.3
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.