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]+ 158.117556 138.9
[M+Na]+ 180.099498 141.6
[M-H]- 156.103004 139.9
[M+NH4]+ 175.144103 151.5
[M+K]+ 196.073438 143.9
[M+H-H2O]+ 140.107540 127.7
[M+HCOO]- 202.108481 157.5
[M+CH3COO]- 216.124131 181.0
[M+Na-2H]- 178.084946 140.2
[M]+ 157.10973142 143.6
[M]- 157.11082858 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