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1,5-Dihydro-3-methoxy-2,4-benzodioxepin

View entire compound with spectra: 6 NMR, 2 FTIR, and 1 Raman

1,5-Dihydro-3-methoxy-2,4-benzodioxepin
SpectraBase Compound ID AXuKObm8AFy
InChI InChI=1S/C10H12O3/c1-11-10-12-6-8-4-2-3-5-9(8)7-13-10/h2-5,10H,6-7H2,1H3
InChIKey DEZKUXIMXCVQEH-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I5DYUnLUufH
Name 1,5-Dihydro-3-methoxy-2,4-benzodioxepin
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 363618
CAS Registry Number 67461-24-9
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI 1S/C10H12O3/c1-11-10-12-6-8-4-2-3-5-9(8)7-13-10/h2-5,10H,6-7H2,1H3
InChIKey DEZKUXIMXCVQEH-UHFFFAOYSA-N
Observed nucleus 1H
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3-methoxy-1H,3H,5H-benzo[e]1,3-dioxepin
Wiley ID SIAL_1HNMR_007542