CID 106822531

3-methoxy-1-(methylamino)cyclobutane-1-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C7H13NO3
SMILES
CNC1(CC(C1)OC)C(=O)O
InChI
InChI=1S/C7H13NO3/c1-8-7(6(9)10)3-5(4-7)11-2/h5,8H,3-4H2,1-2H3,(H,9,10)
InChIKey
YJOXYLRKYMEXCI-UHFFFAOYSA-N
Compound name
3-methoxy-1-(methylamino)cyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.08954 Da
Monoisotopic Mass

-2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.09682 134.6
[M+Na]+ 182.07876 139.6
[M-H]- 158.08226 136.9
[M+NH4]+ 177.12336 149.7
[M+K]+ 198.05270 142.6
[M+H-H2O]+ 142.08680 125.2
[M+HCOO]- 204.08774 155.4
[M+CH3COO]- 218.10339 180.5
[M+Na-2H]- 180.06421 139.4
[M]+ 159.08899 142.7
[M]- 159.09009 142.7
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.