CID 55280862

3-allyloxetan-3-ol

Structural Information

Molecular Formula

C₆H₁₀O₂

SMILES

C=CCC1(COC1)O

InChI

InChI=1S/C6H10O2/c1-2-3-6(7)4-8-5-6/h2,7H,1,3-5H2

InChIKey

YSSORDAPEBFRKL-UHFFFAOYSA-N

Compound name

3-prop-2-enyloxetan-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 46
Patents: 114.06808 Da
Monoisotopic Mass: 0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	115.07536	121.4
[M+Na]+	137.05730	127.6
[M+NH4]+	132.10190	127.0
[M+K]+	153.03124	123.1
[M-H]-	113.06080	120.4
[M+Na-2H]-	135.04275	124.8
[M]+	114.06753	120.8
[M]-	114.06863	120.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe