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]+ 244.11795 153.2
[M+Na]+ 266.09989 158.7
[M-H]- 242.10339 155.4
[M+NH4]+ 261.14449 163.2
[M+K]+ 282.07383 162.4
[M+H-H2O]+ 226.10793 142.3
[M+HCOO]- 288.10887 170.5
[M+CH3COO]- 302.12452 195.1
[M+Na-2H]- 264.08534 154.6
[M]+ 243.11012 166.1
[M]- 243.11122 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.