CID 22990582

4-amino-3-cyclobutylbutanoic acid hydrochloride

Structural Information

Molecular Formula
C8H15NO2
SMILES
C1CC(C1)C(CC(=O)O)CN
InChI
InChI=1S/C8H15NO2/c9-5-7(4-8(10)11)6-2-1-3-6/h6-7H,1-5,9H2,(H,10,11)
InChIKey
VHMURAPTFVBHLS-UHFFFAOYSA-N
Compound name
4-amino-3-cyclobutylbutanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

157.11028 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 138.9
[M+Na]+ 180.09950 141.6
[M-H]- 156.10300 139.9
[M+NH4]+ 175.14410 151.5
[M+K]+ 196.07344 143.9
[M+H-H2O]+ 140.10754 127.7
[M+HCOO]- 202.10848 157.5
[M+CH3COO]- 216.12413 181.0
[M+Na-2H]- 178.08495 140.2
[M]+ 157.10973 143.6
[M]- 157.11083 143.6
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