Dispiro[5.2.5^{9}.2^{6}]hexadecane-3,12-dione

$Dispiro[5.2.5^{9}.2^{6}]hexadecane-3,12-dione$

SpectraBase Compound ID	3JsoCP86yiz
InChI	InChI=1S/C16H24O2/c17-13-1-5-15(6-2-13)9-11-16(12-10-15)7-3-14(18)4-8-16/h1-12H2
InChIKey	FQXQQHOVZCMGAR-UHFFFAOYSA-N Google Search
Mol Weight	248.37 g/mol
Molecular Formula	C16H24O2
Exact Mass	248.17763 g/mol

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SpectraBase Spectrum ID	LbxbFlefDXb
Name	Dispiro[5.2.5^{9}.2^{6}]hexadecane-3,12-dione
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	248.177630011 u
Formula	C16H24O2
InChI	InChI=1S/C16H24O2/c17-13-1-5-15(6-2-13)9-11-16(12-10-15)7-3-14(18)4-8-16/h1-12H2
InChIKey	FQXQQHOVZCMGAR-UHFFFAOYSA-N
Molecular Weight	248.366 g/mol
SMILES	C12(CCC3(CC2)CCC(CC3)=O)CCC(CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR)	0.96553