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

16
Patents

199.12085 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.128126 144.3
[M+Na]+ 222.110068 151.5
[M-H]- 198.113574 147.2
[M+NH4]+ 217.154673 158.5
[M+K]+ 238.084008 154.6
[M+H-H2O]+ 182.118110 135.6
[M+HCOO]- 244.119051 162.4
[M+CH3COO]- 258.134701 188.3
[M+Na-2H]- 220.095516 148.6
[M]+ 199.12030142 155.9
[M]- 199.12139858 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