CID 82473495

1-(3-chlorophenyl)-2-oxoazetidine-3-carboxylic acid

Structural Information

Molecular Formula
C10H8ClNO3
SMILES
C1C(C(=O)N1C2=CC(=CC=C2)Cl)C(=O)O
InChI
InChI=1S/C10H8ClNO3/c11-6-2-1-3-7(4-6)12-5-8(9(12)13)10(14)15/h1-4,8H,5H2,(H,14,15)
InChIKey
ZVFNQXCZKPFMAK-UHFFFAOYSA-N
Compound name
1-(3-chlorophenyl)-2-oxoazetidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.01927 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.02655 141.4
[M+Na]+ 248.00849 150.4
[M+NH4]+ 243.05309 144.9
[M+K]+ 263.98243 147.0
[M-H]- 224.01199 140.2
[M+Na-2H]- 245.99394 145.2
[M]+ 225.01872 141.3
[M]- 225.01982 141.3
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.