CID 84075107

2418713-18-3

Structural Information

Molecular Formula
C8H15NO2
SMILES
CC(C1CCC1)(C(=O)OC)N
InChI
InChI=1S/C8H15NO2/c1-8(9,7(10)11-2)6-4-3-5-6/h6H,3-5,9H2,1-2H3
InChIKey
VRFARTFOIVGIEP-UHFFFAOYSA-N
Compound name
methyl 2-amino-2-cyclobutylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.11028 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 136.0
[M+Na]+ 180.09950 140.0
[M-H]- 156.10300 138.8
[M+NH4]+ 175.14410 149.7
[M+K]+ 196.07344 143.2
[M+H-H2O]+ 140.10754 125.6
[M+HCOO]- 202.10848 155.8
[M+CH3COO]- 216.12413 182.3
[M+Na-2H]- 178.08495 140.1
[M]+ 157.10973 142.8
[M]- 157.11083 142.8
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.