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(1E,3E)-7-(Penta-1,3-dienyl)-2H-benzo[b][1,4]dioxepin-3(4H)-one
SpectraBase Compound ID Gb9i8qGpZ3w
InChI InChI=1S/C14H14O3/c1-2-3-4-5-11-6-7-13-14(8-11)17-10-12(15)9-16-13/h2-8H,9-10H2,1H3/b3-2+,5-4+
InChIKey SFBBGLFHFUVUDX-MQQKCMAXSA-N
Mol Weight 230.26 g/mol
Molecular Formula C14H14O3
Exact Mass 230.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A1NoaFJ09qR
Name (1E,3E)-7-(Penta-1,3-dienyl)-2H-benzo[b][1,4]dioxepin-3(4H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O3
InChI InChI=1S/C14H14O3/c1-2-3-4-5-11-6-7-13-14(8-11)17-10-12(15)9-16-13/h2-8H,9-10H2,1H3/b3-2+,5-4+
InChIKey SFBBGLFHFUVUDX-MQQKCMAXSA-N
Molecular Weight 230.263 g/mol
SMILES c12OCC(COc2ccc(\C=C\C=C\C)c1)=O
SPLASH splash10-001i-3090000000-d4f232e3dfb7e899d3b3
Source of Spectrum F4-42-3034-17
Wiley ID 1674801