CID 55288479

3-(hydroxymethyl)azetidin-3-ol hydrochloride

Structural Information

Molecular Formula
C4H9NO2
SMILES
C1C(CN1)(CO)O
InChI
InChI=1S/C4H9NO2/c6-3-4(7)1-5-2-4/h5-7H,1-3H2
InChIKey
SVGVQQICUXXQHI-UHFFFAOYSA-N
Compound name
3-(hydroxymethyl)azetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

94
Patents

103.06333 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 104.07061 121.1
[M+Na]+ 126.05255 127.0
[M-H]- 102.05605 119.6
[M+NH4]+ 121.09715 136.2
[M+K]+ 142.02649 128.4
[M+H-H2O]+ 86.060590 112.3
[M+HCOO]- 148.06153 138.5
[M+CH3COO]- 162.07718 161.5
[M+Na-2H]- 124.03800 128.3
[M]+ 103.06278 125.5
[M]- 103.06388 125.5
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