CID 14294740

Spiro[4.5]dec-2-ene-1,4-dione

Structural Information

Molecular Formula

C₁₀H₁₂O₂

SMILES

C1CCC2(CC1)C(=O)C=CC2=O

InChI

InChI=1S/C10H12O2/c11-8-4-5-9(12)10(8)6-2-1-3-7-10/h4-5H,1-3,6-7H2

InChIKey

FTDPILJSWFCJMZ-UHFFFAOYSA-N

Compound name

spiro[4.5]dec-2-ene-1,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 164.08372 Da
Monoisotopic Mass: 1.9
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]+	165.09100	136.3
[M+Na]+	187.07294	147.0
[M+NH4]+	182.11754	147.0
[M+K]+	203.04688	140.5
[M-H]-	163.07644	138.9
[M+Na-2H]-	185.05839	142.9
[M]+	164.08317	138.5
[M]-	164.08427	138.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe