CID 108520

60857-05-8

Structural Information

Molecular Formula

C₁₀H₁₆O

SMILES

CC(=CC1CC(=C)CCO1)C

InChI

InChI=1S/C10H16O/c1-8(2)6-10-7-9(3)4-5-11-10/h6,10H,3-5,7H2,1-2H3

InChIKey

JRIATCFPZFOVNP-UHFFFAOYSA-N

Compound name

4-methylidene-2-(2-methylprop-1-enyl)oxane

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 0
References: 50
Patents: 152.12012 Da
Monoisotopic Mass: 2.4
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]+	153.127396	134.3
[M+Na]+	175.109338	139.6
[M-H]-	151.112844	137.9
[M+NH4]+	170.153943	154.2
[M+K]+	191.083278	139.0
[M+H-H2O]+	135.117380	129.2
[M+HCOO]-	197.118321	152.9
[M+CH3COO]-	211.133971	177.0
[M+Na-2H]-	173.094786	138.2
[M]+	152.11957142	130.6
[M]-	152.12066858	130.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe