CID 129981657

[3-(dimethylamino)azetidin-3-yl]methanol dihydrochloride

Structural Information

Molecular Formula
C6H14N2O
SMILES
CN(C)C1(CNC1)CO
InChI
InChI=1S/C6H14N2O/c1-8(2)6(5-9)3-7-4-6/h7,9H,3-5H2,1-2H3
InChIKey
XLRYBBBQQCEYDC-UHFFFAOYSA-N
Compound name
[3-(dimethylamino)azetidin-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

130.11061 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.117886 131.4
[M+Na]+ 153.099828 136.1
[M-H]- 129.103334 132.3
[M+NH4]+ 148.144433 146.4
[M+K]+ 169.073768 138.9
[M+H-H2O]+ 113.107870 121.3
[M+HCOO]- 175.108811 150.8
[M+CH3COO]- 189.124461 175.9
[M+Na-2H]- 151.085276 137.4
[M]+ 130.11006142 137.3
[M]- 130.11115858 137.3
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

No patent data available for this compound.