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Ethyl 5-(Benzo[d][1,3]dioxol-5-yl)benzo[b]oxepine-2-carboxylate
SpectraBase Compound ID 1zxFHteOwjk
InChI InChI=1S/C20H16O5/c1-2-22-20(21)18-10-8-14(15-5-3-4-6-16(15)25-18)13-7-9-17-19(11-13)24-12-23-17/h3-11H,2,12H2,1H3
InChIKey AAZYKAHSADEMEB-UHFFFAOYSA-N
Mol Weight 336.34 g/mol
Molecular Formula C20H16O5
Exact Mass 336.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5xr2NmMQnRy
Name Ethyl 5-(Benzo[d][1,3]dioxol-5-yl)benzo[b]oxepine-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16O5
InChI InChI=1S/C20H16O5/c1-2-22-20(21)18-10-8-14(15-5-3-4-6-16(15)25-18)13-7-9-17-19(11-13)24-12-23-17/h3-11H,2,12H2,1H3
InChIKey AAZYKAHSADEMEB-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.joc.5b02413
Molecular Weight 336.343 g/mol
SMILES c12OC(=CC=C(c2cccc1)c1ccc2c(OCO2)c1)C(=O)OCC
SPLASH splash10-0002-0920000000-febd07a7e6e344461dd9
Source of Spectrum J-81-2132-8f
Wiley ID 1804356