CID 55299692

(2-methylazetidin-2-yl)methanol

Structural Information

Molecular Formula
C5H11NO
SMILES
CC1(CCN1)CO
InChI
InChI=1S/C5H11NO/c1-5(4-7)2-3-6-5/h6-7H,2-4H2,1H3
InChIKey
BYVJKTPUHLLSLC-UHFFFAOYSA-N
Compound name
(2-methylazetidin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

101.08406 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.091336 121.4
[M+Na]+ 124.073278 127.5
[M-H]- 100.076784 121.2
[M+NH4]+ 119.117883 137.4
[M+K]+ 140.047218 129.0
[M+H-H2O]+ 84.081320 112.6
[M+HCOO]- 146.082261 139.8
[M+CH3COO]- 160.097911 164.9
[M+Na-2H]- 122.058726 128.6
[M]+ 101.08351142 126.6
[M]- 101.08460858 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