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9-Methoxy-2H-1-benzoxepin-5-one
SpectraBase Compound ID KTq2UIwJC3b
InChI InChI=1S/C11H10O3/c1-13-10-6-2-4-8-9(12)5-3-7-14-11(8)10/h2-6H,7H2,1H3
InChIKey KVXSMVNHPBTYQR-UHFFFAOYSA-N
Mol Weight 190.2 g/mol
Molecular Formula C11H10O3
Exact Mass 190.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPzNTloJqbQ
Name 9-Methoxy-2H-1-benzoxepin-5-one
Appearance Colorless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10O3
InChI InChI=1S/C11H10O3/c1-13-10-6-2-4-8-9(12)5-3-7-14-11(8)10/h2-6H,7H2,1H3
InChIKey KVXSMVNHPBTYQR-UHFFFAOYSA-N
Instrument Name Hewlett Packard series II
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.219
Molecular Weight 190.198 g/mol
Reported Formula C11H10O3
SMILES C1Oc2c(C(C=C1)=O)cccc2OC
SPLASH splash10-0006-3900000000-4a85b39c22fe416d98d3
Source of Spectrum ARK-2008-180-5c
Thin-Layer Chromatography Rf = 0.18 (ethyl acetate/n-hexane, 1:10)
Wiley ID 1869471