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2-Acetoxy-2,6,11-trimethyl-8-oxatricyclo[8.3.0.0(5,9)]tridec-11-en-7-one
SpectraBase Compound ID 5me4OlGYuFM
InChI InChI=1S/C17H24O4/c1-9-5-6-13-14(9)15-12(10(2)16(19)20-15)7-8-17(13,4)21-11(3)18/h5,10,12-15H,6-8H2,1-4H3
InChIKey COXANKFYXJHAEW-UHFFFAOYSA-N
Mol Weight 292.38 g/mol
Molecular Formula C17H24O4
Exact Mass 292.167459 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FUPhHHHZ8Gi
Name 2-Acetoxy-2,6,11-trimethyl-8-oxatricyclo[8.3.0.0(5,9)]tridec-11-en-7-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 292.167459249 u
Formula C17H24O4
InChI InChI=1S/C17H24O4/c1-9-5-6-13-14(9)15-12(10(2)16(19)20-15)7-8-17(13,4)21-11(3)18/h5,10,12-15H,6-8H2,1-4H3
InChIKey COXANKFYXJHAEW-UHFFFAOYSA-N
SMILES C12OC(=O)C(C2CCC(C2C1C(=CC2)C)(OC(=O)C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.910607