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

2
Patents

99.06841 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.07569 120.3
[M+Na]+ 122.05763 126.7
[M-H]- 98.061134 120.2
[M+NH4]+ 117.10223 136.3
[M+K]+ 138.03157 127.7
[M+H-H2O]+ 82.065670 111.6
[M+HCOO]- 144.06661 139.0
[M+CH3COO]- 158.08226 164.0
[M+Na-2H]- 120.04308 127.6
[M]+ 99.067861 124.9
[M]- 99.068959 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