CID 130510351

Methyl 2-(azetidin-3-yl)-2-hydroxyacetate hydrochloride

Structural Information

Molecular Formula
C6H11NO3
SMILES
COC(=O)C(C1CNC1)O
InChI
InChI=1S/C6H11NO3/c1-10-6(9)5(8)4-2-7-3-4/h4-5,7-8H,2-3H2,1H3
InChIKey
SXDMCDITLJHWOE-UHFFFAOYSA-N
Compound name
methyl 2-(azetidin-3-yl)-2-hydroxyacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.0739 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.08118 131.7
[M+Na]+ 168.06312 135.8
[M-H]- 144.06662 130.9
[M+NH4]+ 163.10772 143.5
[M+K]+ 184.03706 138.6
[M+H-H2O]+ 128.07116 120.7
[M+HCOO]- 190.07210 148.3
[M+CH3COO]- 204.08775 172.4
[M+Na-2H]- 166.04857 134.6
[M]+ 145.07335 137.6
[M]- 145.07445 137.6
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.