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Dihydrobenzopyran, 5-hydroxy-6-(3-hydroxypropyl)-8-methoxy

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Dihydrobenzopyran, 5-hydroxy-6-(3-hydroxypropyl)-8-methoxy
SpectraBase Compound ID 3YCpMNevLaW
InChI InChI=1S/C13H18O4/c1-16-11-8-9(4-2-6-14)12(15)10-5-3-7-17-13(10)11/h8,14-15H,2-7H2,1H3
InChIKey YQSUSLDOFFVNQS-UHFFFAOYSA-N
Mol Weight 238.28 g/mol
Molecular Formula C13H18O4
Exact Mass 238.120509 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7I4nETnSMxz
Name Dihydrobenzopyran, 5-hydroxy-6-(3-hydroxypropyl)-8-methoxy
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 238.120509056 u
Formula C13H18O4
InChI InChI=1S/C13H18O4/c1-16-11-8-9(4-2-6-14)12(15)10-5-3-7-17-13(10)11/h8,14-15H,2-7H2,1H3
InChIKey YQSUSLDOFFVNQS-UHFFFAOYSA-N
Molecular Weight 238.283 g/mol
SMILES C1=C(C(=C2C(=C1OC)OCCC2)O)CCCO
Spectrum/Structure Validation Score (Vapor Phase IR) 0.937109