CID 165657635

2792201-12-6

Structural Information

Molecular Formula
C12H21NO3
SMILES
CC(=O)C1CN(C1(C)C)C(=O)OC(C)(C)C
InChI
InChI=1S/C12H21NO3/c1-8(14)9-7-13(12(9,5)6)10(15)16-11(2,3)4/h9H,7H2,1-6H3
InChIKey
MNIZAYNFTVUIIP-UHFFFAOYSA-N
Compound name
tert-butyl 3-acetyl-2,2-dimethylazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.15215 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.15943 154.4
[M+Na]+ 250.14137 160.4
[M-H]- 226.14487 156.9
[M+NH4]+ 245.18597 167.3
[M+K]+ 266.11531 163.5
[M+H-H2O]+ 210.14941 145.4
[M+HCOO]- 272.15035 170.7
[M+CH3COO]- 286.16600 195.0
[M+Na-2H]- 248.12682 156.3
[M]+ 227.15160 166.0
[M]- 227.15270 166.0
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.