CID 130000966

2768327-51-9

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]+ 102.091336 119.9
[M+Na]+ 124.073278 126.1
[M-H]- 100.076784 119.6
[M+NH4]+ 119.117883 134.3
[M+K]+ 140.047218 127.6
[M+H-H2O]+ 84.081320 110.1
[M+HCOO]- 146.082261 138.4
[M+CH3COO]- 160.097911 166.4
[M+Na-2H]- 122.058726 125.6
[M]+ 101.08351142 125.2
[M]- 101.08460858 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.