CID 155971311

Tert-butyl 3-(2-hydroxy-2-methylpropyl)azetidine-1-carboxylate

Structural Information

Molecular Formula
C12H23NO3
SMILES
CC(C)(C)OC(=O)N1CC(C1)CC(C)(C)O
InChI
InChI=1S/C12H23NO3/c1-11(2,3)16-10(14)13-7-9(8-13)6-12(4,5)15/h9,15H,6-8H2,1-5H3
InChIKey
KQKKCSGNMNTPCA-UHFFFAOYSA-N
Compound name
tert-butyl 3-(2-hydroxy-2-methylpropyl)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.1678 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.17508 158.1
[M+Na]+ 252.15702 161.4
[M+NH4]+ 247.20162 159.5
[M+K]+ 268.13096 160.7
[M-H]- 228.16052 152.8
[M+Na-2H]- 250.14247 157.0
[M]+ 229.16725 155.7
[M]- 229.16835 155.7
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.