CID 11542782

3-methylazetidin-3-ol hydrochloride

Structural Information

Molecular Formula
C4H9NO
SMILES
CC1(CNC1)O
InChI
InChI=1S/C4H9NO/c1-4(6)2-5-3-4/h5-6H,2-3H2,1H3
InChIKey
LDLAEUFQUOXALI-UHFFFAOYSA-N
Compound name
3-methylazetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1796
Patents

87.06841 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 88.075686 116.8
[M+Na]+ 110.057628 123.3
[M-H]- 86.061134 116.8
[M+NH4]+ 105.102233 133.4
[M+K]+ 126.031568 125.1
[M+H-H2O]+ 70.065670 108.2
[M+HCOO]- 132.066611 135.6
[M+CH3COO]- 146.082261 162.0
[M+Na-2H]- 108.043076 124.6
[M]+ 87.06786142 121.7
[M]- 87.06895858 121.7
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

patents stripe