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4-chloro-3,3-dimethyl-5-hydroxynaphtho[1,2-b]furan-2(3H)-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 Raman

4-chloro-3,3-dimethyl-5-hydroxynaphtho[1,2-b]furan-2(3H)-one
SpectraBase Compound ID JDGxne5oJ1b
InChI InChI=1S/C14H11ClO3/c1-14(2)9-10(15)11(16)7-5-3-4-6-8(7)12(9)18-13(14)17/h3-6,16H,1-2H3
InChIKey CGMUOGMOCRQBGC-UHFFFAOYSA-N
Mol Weight 262.69 g/mol
Molecular Formula C14H11ClO3
Exact Mass 262.039672 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID Kuv1Uz3wPJz
Name 4-Chloro-3,3-dimethyl-5-hydroxynaphtho[1,2-B]furan-2(3H)-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.039671911 u
Formula C14H11ClO3
InChI InChI=1S/C14H11ClO3/c1-14(2)9-10(15)11(16)7-5-3-4-6-8(7)12(9)18-13(14)17/h3-6,16H,1-2H3
InChIKey CGMUOGMOCRQBGC-UHFFFAOYSA-N
Molecular Weight 262.692 g/mol
SMILES OC1=C(C=2C(C(OC2C=2C=CC=CC12)=O)(C)C)Cl
Spectrum/Structure Validation Score (Raman) 0.773577