CID 130000966

(3-methylazetidin-2-yl)methanol hydrochloride

Structural Information

Molecular Formula
C5H11NO
SMILES
CC1CNC1CO
InChI
InChI=1S/C5H11NO/c1-4-2-6-5(4)3-7/h4-7H,2-3H2,1H3
InChIKey
NLFGNZMMTPEJIN-UHFFFAOYSA-N
Compound name
(3-methylazetidin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

101.08406 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.09134 119.9
[M+Na]+ 124.07328 126.1
[M-H]- 100.07678 119.6
[M+NH4]+ 119.11788 134.3
[M+K]+ 140.04722 127.6
[M+H-H2O]+ 84.081320 110.1
[M+HCOO]- 146.08226 138.4
[M+CH3COO]- 160.09791 166.4
[M+Na-2H]- 122.05873 125.6
[M]+ 101.08351 125.2
[M]- 101.08461 125.2
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.