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1-[4-Acetoxy-2-methyl-2-(2-oxoethyl)cyclobutyl]ethanone
SpectraBase Compound ID CBcCyGU4CBJ
InChI InChI=1S/C11H16O4/c1-7(13)10-9(15-8(2)14)6-11(10,3)4-5-12/h5,9-10H,4,6H2,1-3H3
InChIKey TZBOKMCGNJSPEB-UHFFFAOYSA-N
Mol Weight 212.24 g/mol
Molecular Formula C11H16O4
Exact Mass 212.104859 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID F0yQGoOnr1r
Name 1-[4-Acetoxy-2-methyl-2-(2-oxoethyl)cyclobutyl]ethanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.104858991 u
Formula C11H16O4
InChI InChI=1S/C11H16O4/c1-7(13)10-9(15-8(2)14)6-11(10,3)4-5-12/h5,9-10H,4,6H2,1-3H3
InChIKey TZBOKMCGNJSPEB-UHFFFAOYSA-N
Molecular Weight 212.245 g/mol
SMILES C1(C(C(=O)C)C(C1)OC(=O)C)(CC=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.975727