CID 131307254

Tert-butyl 3-hydroxy-2,2-dimethylazetidine-1-carboxylate

Structural Information

Molecular Formula
C10H19NO3
SMILES
CC1(C(CN1C(=O)OC(C)(C)C)O)C
InChI
InChI=1S/C10H19NO3/c1-9(2,3)14-8(13)11-6-7(12)10(11,4)5/h7,12H,6H2,1-5H3
InChIKey
WDNPDFRFBLSJBI-UHFFFAOYSA-N
Compound name
tert-butyl 3-hydroxy-2,2-dimethylazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

201.13649 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.14377 147.9
[M+Na]+ 224.12571 154.3
[M-H]- 200.12921 149.3
[M+NH4]+ 219.17031 161.3
[M+K]+ 240.09965 157.1
[M+H-H2O]+ 184.13375 139.2
[M+HCOO]- 246.13469 164.2
[M+CH3COO]- 260.15034 186.7
[M+Na-2H]- 222.11116 151.4
[M]+ 201.13594 158.3
[M]- 201.13704 158.3
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

patents stripe