CID 53441206

Methyl 2-amino-2-cyclobutylacetate hydrochloride

Structural Information

Molecular Formula
C7H13NO2
SMILES
COC(=O)C(C1CCC1)N
InChI
InChI=1S/C7H13NO2/c1-10-7(9)6(8)5-3-2-4-5/h5-6H,2-4,8H2,1H3
InChIKey
WPMQPLHPHZACOB-UHFFFAOYSA-N
Compound name
methyl 2-amino-2-cyclobutylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

143.09464 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.101916 132.9
[M+Na]+ 166.083858 136.5
[M-H]- 142.087364 135.5
[M+NH4]+ 161.128463 146.9
[M+K]+ 182.057798 140.0
[M+H-H2O]+ 126.091900 121.8
[M+HCOO]- 188.092841 153.4
[M+CH3COO]- 202.108491 179.9
[M+Na-2H]- 164.069306 135.4
[M]+ 143.09409142 139.0
[M]- 143.09518858 139.0
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

patents stripe