CID 155822228

3-oxopyrrolidine-1-carbonyl chloride

Structural Information

Molecular Formula
C5H6ClNO2
SMILES
C1CN(CC1=O)C(=O)Cl
InChI
InChI=1S/C5H6ClNO2/c6-5(9)7-2-1-4(8)3-7/h1-3H2
InChIKey
FPJLBBWOGFXFGO-UHFFFAOYSA-N
Compound name
3-oxopyrrolidine-1-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

147.00871 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.015986 126.5
[M+Na]+ 169.997928 135.4
[M-H]- 146.001434 128.7
[M+NH4]+ 165.042533 149.0
[M+K]+ 185.971868 133.3
[M+H-H2O]+ 130.005970 121.7
[M+HCOO]- 192.006911 144.0
[M+CH3COO]- 206.022561 170.1
[M+Na-2H]- 167.983376 130.0
[M]+ 147.00816142 126.1
[M]- 147.00925858 126.1
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.