CID 145913182

5-oxaspiro[3.4]oct-7-ene

Structural Information

Molecular Formula

C₇H₁₀O

SMILES

C1CC2(C1)C=CCO2

InChI

InChI=1S/C7H10O/c1-3-7(4-1)5-2-6-8-7/h2,5H,1,3-4,6H2

InChIKey

DLNYTPUMLGKPRI-UHFFFAOYSA-N

Compound name

5-oxaspiro[3.4]oct-7-ene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 110.073166 Da
Monoisotopic Mass: 1.0
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]+	111.08044	117.4
[M+Na]+	133.06238	124.1
[M+NH4]+	128.10699	124.9
[M+K]+	149.03632	120.4
[M-H]-	109.06589	118.7
[M+Na-2H]-	131.04783	122.7
[M]+	110.07262	117.6
[M]-	110.07371	117.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe