CID 53994566

Ethyl 2-amino-2-cyclobutylacetate hydrochloride

Structural Information

Molecular Formula
C8H15NO2
SMILES
CCOC(=O)C(C1CCC1)N
InChI
InChI=1S/C8H15NO2/c1-2-11-8(10)7(9)6-4-3-5-6/h6-7H,2-5,9H2,1H3
InChIKey
UZHAOXIDNMVYQX-UHFFFAOYSA-N
Compound name
ethyl 2-amino-2-cyclobutylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

157.11028 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 137.6
[M+Na]+ 180.09950 140.8
[M-H]- 156.10300 140.1
[M+NH4]+ 175.14410 151.0
[M+K]+ 196.07344 144.1
[M+H-H2O]+ 140.10754 126.3
[M+HCOO]- 202.10848 157.8
[M+CH3COO]- 216.12413 182.8
[M+Na-2H]- 178.08495 139.5
[M]+ 157.10973 144.1
[M]- 157.11083 144.1
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