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(E)-1-(1-cyclohexenyl)but-2-en-1-one
SpectraBase Compound ID Cke57yGSJnn
InChI InChI=1S/C10H14O/c1-2-6-10(11)9-7-4-3-5-8-9/h2,6-7H,3-5,8H2,1H3/b6-2+
InChIKey HGKVDALQZGEOJH-QHHAFSJGSA-N
Mol Weight 150.22 g/mol
Molecular Formula C10H14O
Exact Mass 150.104465 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HUggKoT4bvK
Name (E)-1-(1-Cyclohexenyl)but-2-en-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 150.104465070 u
Formula C10H14O
InChI InChI=1S/C10H14O/c1-2-6-10(11)9-7-4-3-5-8-9/h2,6-7H,3-5,8H2,1H3/b6-2+
InChIKey HGKVDALQZGEOJH-QHHAFSJGSA-N
Molecular Weight 150.221 g/mol
SMILES C(=O)(C=1CCCCC1)\C=C\C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973397