CID 89808883

(3-methylazetidin-3-yl)methanol hydrochloride

Structural Information

Molecular Formula
C5H11NO
SMILES
CC1(CNC1)CO
InChI
InChI=1S/C5H11NO/c1-5(4-7)2-6-3-5/h6-7H,2-4H2,1H3
InChIKey
SOYCFNZZDDLHII-UHFFFAOYSA-N
Compound name
(3-methylazetidin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

84
Patents

101.08406 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.09134 121.4
[M+Na]+ 124.07328 127.5
[M-H]- 100.07678 121.2
[M+NH4]+ 119.11788 137.4
[M+K]+ 140.04722 129.0
[M+H-H2O]+ 84.081320 112.6
[M+HCOO]- 146.08226 139.8
[M+CH3COO]- 160.09791 164.9
[M+Na-2H]- 122.05873 128.6
[M]+ 101.08351 126.6
[M]- 101.08461 126.6
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

patents stripe