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6,6-Dimethyl-2-phenyl-5,7-dioxaspiro[2.5]octane-4,8-dione
SpectraBase Compound ID 4qzcOeZ20tT
InChI InChI=1S/C14H14O4/c1-13(2)17-11(15)14(12(16)18-13)8-10(14)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
InChIKey RJSCODSWRYREHR-UHFFFAOYSA-N
Mol Weight 246.26 g/mol
Molecular Formula C14H14O4
Exact Mass 246.089209 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 490KWIAgFPv
Name 6,6-Dimethyl-2-phenyl-5,7-dioxaspiro[2.5]octane-4,8-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 246.089208927 u
Formula C14H14O4
InChI InChI=1S/C14H14O4/c1-13(2)17-11(15)14(12(16)18-13)8-10(14)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
InChIKey RJSCODSWRYREHR-UHFFFAOYSA-N
Molecular Weight 246.262 g/mol
SMILES C1(CC11C(OC(OC1=O)(C)C)=O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.972413