CID 165803821

Rac-(1r,2s,3r)-2-amino-3-methoxycyclobutan-1-ol hydrochloride

Structural Information

Molecular Formula
C5H11NO2
SMILES
CO[C@@H]1C[C@H]([C@@H]1N)O
InChI
InChI=1S/C5H11NO2/c1-8-4-2-3(7)5(4)6/h3-5,7H,2,6H2,1H3/t3-,4-,5+/m1/s1
InChIKey
HHMUSBUVSRKTLP-WDCZJNDASA-N
Compound name
(1R,2S,3R)-2-amino-3-methoxycyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

117.07898 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.086256 122.1
[M+Na]+ 140.068198 128.3
[M-H]- 116.071704 124.3
[M+NH4]+ 135.112803 137.3
[M+K]+ 156.042138 130.9
[M+H-H2O]+ 100.076240 112.2
[M+HCOO]- 162.077181 143.7
[M+CH3COO]- 176.092831 173.6
[M+Na-2H]- 138.053646 126.5
[M]+ 117.07843142 128.6
[M]- 117.07952858 128.6
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

No patent data available for this compound.