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2'-Hydroxy-4'-methoxyacetophenone, 2-methylpropyl ether
SpectraBase Compound ID IGSWUJf48Lz
InChI InChI=1S/C13H18O3/c1-9(2)8-16-13-7-11(15-4)5-6-12(13)10(3)14/h5-7,9H,8H2,1-4H3
InChIKey HBRVXGSLSNUNJI-UHFFFAOYSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1qyle7IxUhK
Name 2'-Hydroxy-4'-methoxyacetophenone, 2-methylpropyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.125594437 u
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-9(2)8-16-13-7-11(15-4)5-6-12(13)10(3)14/h5-7,9H,8H2,1-4H3
InChIKey HBRVXGSLSNUNJI-UHFFFAOYSA-N
Molecular Weight 222.284 g/mol
SMILES C1(=C(C=C(C=C1)OC)OCC(C)C)C(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.943354