CID 12677530

79232-62-5

Structural Information

Molecular Formula
C8H13NO3
SMILES
CCOC(=O)C1(CCNC1=O)C
InChI
InChI=1S/C8H13NO3/c1-3-12-7(11)8(2)4-5-9-6(8)10/h3-5H2,1-2H3,(H,9,10)
InChIKey
LDJOKVMAYHUXLD-UHFFFAOYSA-N
Compound name
ethyl 3-methyl-2-oxopyrrolidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

61
Patents

171.08954 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.096816 136.0
[M+Na]+ 194.078758 143.4
[M-H]- 170.082264 136.9
[M+NH4]+ 189.123363 158.1
[M+K]+ 210.052698 142.4
[M+H-H2O]+ 154.086800 131.3
[M+HCOO]- 216.087741 156.0
[M+CH3COO]- 230.103391 174.3
[M+Na-2H]- 192.064206 139.4
[M]+ 171.08899142 134.9
[M]- 171.09008858 134.9
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

patents stripe