CID 14616896

6-methyl-1-oxaspiro[2.5]octane

Structural Information

Molecular Formula

C₈H₁₄O

SMILES

CC1CCC2(CC1)CO2

InChI

InChI=1S/C8H14O/c1-7-2-4-8(5-3-7)6-9-8/h7H,2-6H2,1H3

InChIKey

QWEHPDHDKIVFDV-UHFFFAOYSA-N

Compound name

6-methyl-1-oxaspiro[2.5]octane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 33
Patents: 126.10446 Da
Monoisotopic Mass: 1.7
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]+	127.11174	128.9
[M+Na]+	149.09368	142.2
[M+NH4]+	144.13828	140.9
[M+K]+	165.06762	135.6
[M-H]-	125.09718	140.5
[M+Na-2H]-	147.07913	138.8
[M]+	126.10391	135.4
[M]-	126.10501	135.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe