CID 10654218

72320-39-9

Structural Information

Molecular Formula
C4H9NO
SMILES
C1C[C@@H]([C@@H]1N)O
InChI
InChI=1S/C4H9NO/c5-3-1-2-4(3)6/h3-4,6H,1-2,5H2/t3-,4+/m1/s1
InChIKey
WXKBWWIWJCCING-DMTCNVIQSA-N
Compound name
(1S,2R)-2-aminocyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

189
Patents

87.06841 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 88.075686 114.9
[M+Na]+ 110.05763 120.8
[M-H]- 86.061134 117.0
[M+NH4]+ 105.10223 131.1
[M+K]+ 126.03157 123.2
[M+H-H2O]+ 70.065670 105.3
[M+HCOO]- 132.06661 136.6
[M+CH3COO]- 146.08226 167.5
[M+Na-2H]- 108.04308 120.6
[M]+ 87.067861 119.3
[M]- 87.068959 119.3
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