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7-Hydroxy-6-methoxy-2H-1-benzopyran-2-one

View entire compound with spectra: 30 NMR, 2 FTIR, 2 Raman, and 19 MS (GC)

7-Hydroxy-6-methoxy-2H-1-benzopyran-2-one
SpectraBase Compound ID E61Vf8JLGPn
InChI InChI=1S/C10H8O4/c1-13-9-4-6-2-3-10(12)14-8(6)5-7(9)11/h2-5,11H,1H3
InChIKey RODXRVNMMDRFIK-UHFFFAOYSA-N
Mol Weight 192.17 g/mol
Molecular Formula C10H8O4
Exact Mass 192.042259 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 55RF3bqx4nE
Name Scopoletin
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 246581
CAS Registry Number 92-61-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8O4
InChI InChI=1S/C10H8O4/c1-13-9-4-6-2-3-10(12)14-8(6)5-7(9)11/h2-5,11H,1H3
InChIKey RODXRVNMMDRFIK-UHFFFAOYSA-N
Observed nucleus 13C
Purity 95%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_004136