CID 137944272

2168125-49-1

Structural Information

Molecular Formula
C11H17NO5
SMILES
CCOC(=O)C1C(=O)CN1C(=O)OC(C)(C)C
InChI
InChI=1S/C11H17NO5/c1-5-16-9(14)8-7(13)6-12(8)10(15)17-11(2,3)4/h8H,5-6H2,1-4H3
InChIKey
PRPGKVWGWIPRIX-UHFFFAOYSA-N
Compound name
1-O-tert-butyl 2-O-ethyl 3-oxoazetidine-1,2-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.11067 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.117946 153.2
[M+Na]+ 266.099888 158.7
[M-H]- 242.103394 155.4
[M+NH4]+ 261.144493 163.2
[M+K]+ 282.073828 162.4
[M+H-H2O]+ 226.107930 142.3
[M+HCOO]- 288.108871 170.5
[M+CH3COO]- 302.124521 195.1
[M+Na-2H]- 264.085336 154.6
[M]+ 243.11012142 166.1
[M]- 243.11121858 166.1
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.