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2-[1',2'-Dihydroxy-1'-(methylethyl)]-5-methoxy-2,3-dihydrobenzo[b]furan
SpectraBase Compound ID 3kK6MMMM9zz
InChI InChI=1S/C12H16O4/c1-7(13)12(14)11-6-8-5-9(15-2)3-4-10(8)16-11/h3-5,7,11-14H,6H2,1-2H3
InChIKey NYKRZONVNIDUGG-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DmV0bKDyNA1
Name 2-[1',2'-Dihydroxy-1'-(methylethyl)]-5-methoxy-2,3-dihydrobenzo[B]furan
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 224.104858991 u
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-7(13)12(14)11-6-8-5-9(15-2)3-4-10(8)16-11/h3-5,7,11-14H,6H2,1-2H3
InChIKey NYKRZONVNIDUGG-UHFFFAOYSA-N
Molecular Weight 224.256 g/mol
SMILES C1(OC=2C=CC(=CC2C1)OC)C(C(O)C)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.949098