CID 121604730

Tert-butyl 3-aminooxetane-3-carboxylate

Structural Information

Molecular Formula
C8H15NO3
SMILES
CC(C)(C)OC(=O)C1(COC1)N
InChI
InChI=1S/C8H15NO3/c1-7(2,3)12-6(10)8(9)4-11-5-8/h4-5,9H2,1-3H3
InChIKey
HINMFKGGHGZFKQ-UHFFFAOYSA-N
Compound name
tert-butyl 3-aminooxetane-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.1052 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.11248 138.2
[M+Na]+ 196.09442 143.0
[M-H]- 172.09792 142.0
[M+NH4]+ 191.13902 152.1
[M+K]+ 212.06836 147.7
[M+H-H2O]+ 156.10246 129.1
[M+HCOO]- 218.10340 157.4
[M+CH3COO]- 232.11905 183.2
[M+Na-2H]- 194.07987 144.7
[M]+ 173.10465 147.3
[M]- 173.10575 147.3
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.