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1-(4-Methoxyphenyl)-2-(1-hydroxycyclopropyl)ethanone
SpectraBase Compound ID 2dlpnMmD8Yt
InChI InChI=1S/C12H14O3/c1-15-10-4-2-9(3-5-10)11(13)8-12(14)6-7-12/h2-5,14H,6-8H2,1H3
InChIKey VFHVBXLUXUDGEB-UHFFFAOYSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2jSk8wpVrbb
Name 1-(4-Methoxyphenyl)-2-(1-hydroxycyclopropyl)ethanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.094294308 u
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-15-10-4-2-9(3-5-10)11(13)8-12(14)6-7-12/h2-5,14H,6-8H2,1H3
InChIKey VFHVBXLUXUDGEB-UHFFFAOYSA-N
Molecular Weight 206.241 g/mol
SMILES C1(CC(C2=CC=C(C=C2)OC)=O)(CC1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.95726