CID 55283732

Rac-2-[(1r,2r)-2-aminocyclobutyl]acetic acid hydrochloride

Structural Information

Molecular Formula
C6H11NO2
SMILES
C1C[C@H]([C@H]1CC(=O)O)N
InChI
InChI=1S/C6H11NO2/c7-5-2-1-4(5)3-6(8)9/h4-5H,1-3,7H2,(H,8,9)/t4-,5-/m1/s1
InChIKey
YDXKXPHBTAVLIZ-RFZPGFLSSA-N
Compound name
2-[(1R,2R)-2-aminocyclobutyl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

129.07898 Da
Monoisotopic Mass

-2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.086256 127.6
[M+Na]+ 152.068198 132.4
[M-H]- 128.071704 129.3
[M+NH4]+ 147.112803 141.8
[M+K]+ 168.042138 134.7
[M+H-H2O]+ 112.076240 117.2
[M+HCOO]- 174.077181 148.0
[M+CH3COO]- 188.092831 175.4
[M+Na-2H]- 150.053646 130.7
[M]+ 129.07843142 132.7
[M]- 129.07952858 132.7
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.