CID 65918814

3-ethenylazetidin-3-ol hydrochloride

Structural Information

Molecular Formula
C5H9NO
SMILES
C=CC1(CNC1)O
InChI
InChI=1S/C5H9NO/c1-2-5(7)3-6-4-5/h2,6-7H,1,3-4H2
InChIKey
SBFXOHASBHXRMI-UHFFFAOYSA-N
Compound name
3-ethenylazetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

99.06841 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.075686 120.3
[M+Na]+ 122.057628 126.7
[M-H]- 98.061134 120.2
[M+NH4]+ 117.102233 136.3
[M+K]+ 138.031568 127.7
[M+H-H2O]+ 82.065670 111.6
[M+HCOO]- 144.066611 139.0
[M+CH3COO]- 158.082261 164.0
[M+Na-2H]- 120.043076 127.6
[M]+ 99.06786142 124.9
[M]- 99.06895858 124.9
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