CID 165595677

Tert-butyl n-[3-(2-hydroxyethyl)azetidin-3-yl]carbamate

Structural Information

Molecular Formula
C10H20N2O3
SMILES
CC(C)(C)OC(=O)NC1(CNC1)CCO
InChI
InChI=1S/C10H20N2O3/c1-9(2,3)15-8(14)12-10(4-5-13)6-11-7-10/h11,13H,4-7H2,1-3H3,(H,12,14)
InChIKey
HXTXKKMRTCGQTK-UHFFFAOYSA-N
Compound name
tert-butyl N-[3-(2-hydroxyethyl)azetidin-3-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.1474 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.154676 156.3
[M+Na]+ 239.136618 159.2
[M-H]- 215.140124 155.2
[M+NH4]+ 234.181223 167.2
[M+K]+ 255.110558 161.2
[M+H-H2O]+ 199.144660 145.9
[M+HCOO]- 261.145601 171.8
[M+CH3COO]- 275.161251 186.7
[M+Na-2H]- 237.122066 160.3
[M]+ 216.14685142 163.0
[M]- 216.14794858 163.0
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.