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3-Ethylidenetetrahydro-6-(1-propenyl)-2H-pyran-2-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3-Ethylidenetetrahydro-6-(1-propenyl)-2H-pyran-2-one
SpectraBase Compound ID 3HTCIptyXf9
InChI InChI=1S/C10H14O2/c1-3-5-9-7-6-8(4-2)10(11)12-9/h3-5,9H,6-7H2,1-2H3/b5-3+,8-4+
InChIKey RQSAWLPCUACXOO-MSLMYCKWSA-N
Mol Weight 166.22 g/mol
Molecular Formula C10H14O2
Exact Mass 166.09938 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DwrgQHAuv3d
Name 3-Ethylidenetetrahydro-6-(1-propenyl)-2H-pyran-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 166.099379689 u
Formula C10H14O2
InChI InChI=1S/C10H14O2/c1-3-5-9-7-6-8(4-2)10(11)12-9/h3-5,9H,6-7H2,1-2H3/b5-3+,8-4+
InChIKey RQSAWLPCUACXOO-MSLMYCKWSA-N
Molecular Weight 166.220 g/mol
SMILES C1(OC(\C=C\C)CC\C1=C\C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926318