CID 84075622

2361634-21-9

Structural Information

Molecular Formula
C9H14N2O3
SMILES
COC(=O)C1CC(=O)N(C1)C2CNC2
InChI
InChI=1S/C9H14N2O3/c1-14-9(13)6-2-8(12)11(5-6)7-3-10-4-7/h6-7,10H,2-5H2,1H3
InChIKey
YJLDVCLFARYUGI-UHFFFAOYSA-N
Compound name
methyl 1-(azetidin-3-yl)-5-oxopyrrolidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.10045 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.10773 141.2
[M+Na]+ 221.08967 145.9
[M-H]- 197.09317 143.4
[M+NH4]+ 216.13427 152.2
[M+K]+ 237.06361 147.5
[M+H-H2O]+ 181.09771 129.2
[M+HCOO]- 243.09865 157.7
[M+CH3COO]- 257.11430 183.4
[M+Na-2H]- 219.07512 141.5
[M]+ 198.09990 146.8
[M]- 198.10100 146.8
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.