CID 119031239

2-amino-3,3-dicyclobutylpropanoic acid hydrochloride

Structural Information

Molecular Formula
C11H19NO2
SMILES
C1CC(C1)C(C2CCC2)C(C(=O)O)N
InChI
InChI=1S/C11H19NO2/c12-10(11(13)14)9(7-3-1-4-7)8-5-2-6-8/h7-10H,1-6,12H2,(H,13,14)
InChIKey
MLCZDJHSVYPJJX-UHFFFAOYSA-N
Compound name
2-amino-3,3-di(cyclobutyl)propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

197.14159 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.14887 159.3
[M+Na]+ 220.13081 157.2
[M+NH4]+ 215.17541 158.2
[M+K]+ 236.10475 157.2
[M-H]- 196.13431 155.2
[M+Na-2H]- 218.11626 156.3
[M]+ 197.14104 155.2
[M]- 197.14214 155.2
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