CID 9837243

Brivaracetam

Structural Information

Molecular Formula
C11H20N2O2
SMILES
CCC[C@@H]1CC(=O)N(C1)[C@@H](CC)C(=O)N
InChI
InChI=1S/C11H20N2O2/c1-3-5-8-6-10(14)13(7-8)9(4-2)11(12)15/h8-9H,3-7H2,1-2H3,(H2,12,15)/t8-,9+/m1/s1
InChIKey
MSYKRHVOOPPJKU-BDAKNGLRSA-N
Compound name
(2S)-2-[(4R)-2-oxo-4-propylpyrrolidin-1-yl]butanamide
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

322
References

3585
Patents

212.15248 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.15976 151.5
[M+Na]+ 235.14170 156.8
[M-H]- 211.14520 152.7
[M+NH4]+ 230.18630 170.2
[M+K]+ 251.11564 155.3
[M+H-H2O]+ 195.14974 145.0
[M+HCOO]- 257.15068 171.1
[M+CH3COO]- 271.16633 191.4
[M+Na-2H]- 233.12715 149.8
[M]+ 212.15193 149.6
[M]- 212.15303 149.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe