CID 118996731

Tert-butyl (1-(2-hydroxyethyl)azetidin-3-yl)(methyl)carbamate

Structural Information

Molecular Formula
C11H22N2O3
SMILES
CC(C)(C)OC(=O)N(C)C1CN(C1)CCO
InChI
InChI=1S/C11H22N2O3/c1-11(2,3)16-10(15)12(4)9-7-13(8-9)5-6-14/h9,14H,5-8H2,1-4H3
InChIKey
FYTUWAYHMXBNSD-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-(2-hydroxyethyl)azetidin-3-yl]-N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.16304 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.17032 158.3
[M+Na]+ 253.15226 161.5
[M-H]- 229.15576 159.9
[M+NH4]+ 248.19686 168.3
[M+K]+ 269.12620 165.3
[M+H-H2O]+ 213.16030 146.3
[M+HCOO]- 275.16124 175.6
[M+CH3COO]- 289.17689 197.0
[M+Na-2H]- 251.13771 159.9
[M]+ 230.16249 168.5
[M]- 230.16359 168.5
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.