CID 118703239

1370018-27-1

Structural Information

Molecular Formula
C9H13NO5
SMILES
CC(C)(C)OC(=O)N1CC(C1=O)C(=O)O
InChI
InChI=1S/C9H13NO5/c1-9(2,3)15-8(14)10-4-5(6(10)11)7(12)13/h5H,4H2,1-3H3,(H,12,13)
InChIKey
RAFPPTCCCBDDOC-UHFFFAOYSA-N
Compound name
1-[(2-methylpropan-2-yl)oxycarbonyl]-2-oxoazetidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.07938 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.08666 150.8
[M+Na]+ 238.06860 154.1
[M+NH4]+ 233.11320 150.9
[M+K]+ 254.04254 154.6
[M-H]- 214.07210 144.4
[M+Na-2H]- 236.05405 148.6
[M]+ 215.07883 147.7
[M]- 215.07993 147.7
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.