CID 15199114

171919-76-9

Structural Information

Molecular Formula
C9H15NO3
SMILES
C[C@H]1C(=O)CN1C(=O)OC(C)(C)C
InChI
InChI=1S/C9H15NO3/c1-6-7(11)5-10(6)8(12)13-9(2,3)4/h6H,5H2,1-4H3/t6-/m0/s1
InChIKey
OPQMXTJLDQEDTI-LURJTMIESA-N
Compound name
tert-butyl (2S)-2-methyl-3-oxoazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

185.1052 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.11248 139.7
[M+Na]+ 208.09442 146.5
[M-H]- 184.09792 142.4
[M+NH4]+ 203.13902 152.4
[M+K]+ 224.06836 149.6
[M+H-H2O]+ 168.10246 129.6
[M+HCOO]- 230.10340 158.1
[M+CH3COO]- 244.11905 185.8
[M+Na-2H]- 206.07987 143.2
[M]+ 185.10465 150.6
[M]- 185.10575 150.6
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.