CID 118898178

Tert-butyl 2,2-dimethyl-3-oxoazetidine-1-carboxylate

Structural Information

Molecular Formula
C10H17NO3
SMILES
CC1(C(=O)CN1C(=O)OC(C)(C)C)C
InChI
InChI=1S/C10H17NO3/c1-9(2,3)14-8(13)11-6-7(12)10(11,4)5/h6H2,1-5H3
InChIKey
XBMJUOJTMXHRBL-UHFFFAOYSA-N
Compound name
tert-butyl 2,2-dimethyl-3-oxoazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

199.12085 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.12813 144.3
[M+Na]+ 222.11007 151.5
[M-H]- 198.11357 147.2
[M+NH4]+ 217.15467 158.5
[M+K]+ 238.08401 154.6
[M+H-H2O]+ 182.11811 135.6
[M+HCOO]- 244.11905 162.4
[M+CH3COO]- 258.13470 188.3
[M+Na-2H]- 220.09552 148.6
[M]+ 199.12030 155.9
[M]- 199.12140 155.9
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

patents stripe