CID 68664941

120871-64-9

Structural Information

Molecular Formula

C₇H₁₂O₂

SMILES

C=CC[C@@H]1COC[C@H]1O

InChI

InChI=1S/C7H12O2/c1-2-3-6-4-9-5-7(6)8/h2,6-8H,1,3-5H2/t6-,7-/m1/s1

InChIKey

DVVPXYBQHQSSCX-RNFRBKRXSA-N

Compound name

(3S,4R)-4-prop-2-enyloxolan-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 128.08372 Da
Monoisotopic Mass: 0.6
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]+	129.09100	126.5
[M+Na]+	151.07294	136.3
[M+NH4]+	146.11754	134.7
[M+K]+	167.04688	133.1
[M-H]-	127.07644	128.2
[M+Na-2H]-	149.05839	129.7
[M]+	128.08317	128.1
[M]-	128.08427	128.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe