CID 71742706

3-cyclopropyloxetan-3-ol

Structural Information

Molecular Formula

C₆H₁₀O₂

SMILES

C1CC1C2(COC2)O

InChI

InChI=1S/C6H10O2/c7-6(3-8-4-6)5-1-2-5/h5,7H,1-4H2

InChIKey

JIKWOYUXWHYYMZ-UHFFFAOYSA-N

Compound name

3-cyclopropyloxetan-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 27
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	116.7
[M+Na]+	137.05730	124.6
[M-H]-	113.06080	124.1
[M+NH4]+	132.10190	128.4
[M+K]+	153.03124	128.2
[M+H-H2O]+	97.065340	107.9
[M+HCOO]-	159.06628	137.0
[M+CH3COO]-	173.08193	172.2
[M+Na-2H]-	135.04275	126.0
[M]+	114.06753	126.7
[M]-	114.06863	126.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe