CID 165889004

Methyl 2-(3-methoxyazetidin-3-yl)acetate hydrochloride

Structural Information

Molecular Formula
C7H13NO3
SMILES
COC(=O)CC1(CNC1)OC
InChI
InChI=1S/C7H13NO3/c1-10-6(9)3-7(11-2)4-8-5-7/h8H,3-5H2,1-2H3
InChIKey
CMEGVFCMWCWRNQ-UHFFFAOYSA-N
Compound name
methyl 2-(3-methoxyazetidin-3-yl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.08954 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.09682 134.3
[M+Na]+ 182.07876 139.7
[M-H]- 158.08226 135.1
[M+NH4]+ 177.12336 148.4
[M+K]+ 198.05270 142.6
[M+H-H2O]+ 142.08680 124.6
[M+HCOO]- 204.08774 153.1
[M+CH3COO]- 218.10339 176.5
[M+Na-2H]- 180.06421 139.8
[M]+ 159.08899 143.4
[M]- 159.09009 143.4
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.