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]+ 130.08626 127.6
[M+Na]+ 152.06820 132.4
[M-H]- 128.07170 129.3
[M+NH4]+ 147.11280 141.8
[M+K]+ 168.04214 134.7
[M+H-H2O]+ 112.07624 117.2
[M+HCOO]- 174.07718 148.0
[M+CH3COO]- 188.09283 175.4
[M+Na-2H]- 150.05365 130.7
[M]+ 129.07843 132.7
[M]- 129.07953 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.