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7-Bromo-2H-1-benzoxepin-5-one
SpectraBase Compound ID 1vr9sGDdnpw
InChI InChI=1S/C10H7BrO2/c11-7-3-4-10-8(6-7)9(12)2-1-5-13-10/h1-4,6H,5H2
InChIKey QGJYZIFOJNWDKD-UHFFFAOYSA-N
Mol Weight 239.07 g/mol
Molecular Formula C10H7BrO2
Exact Mass 237.962942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4NCL407pH0S
Name 7-Bromo-2H-1-benzoxepin-5-one
Appearance Colorless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7BrO2
InChI InChI=1S/C10H7BrO2/c11-7-3-4-10-8(6-7)9(12)2-1-5-13-10/h1-4,6H,5H2
InChIKey QGJYZIFOJNWDKD-UHFFFAOYSA-N
Instrument Name Hewlett Packard series II
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.219
Molecular Weight 239.068 g/mol
Reported Formula C10H7BrO2
SMILES C1Oc2c(C(C=C1)=O)cc(cc2)Br
SPLASH splash10-0nn9-2690000000-7475eebec85fcbad728d
Source of Spectrum ARK-2008-180-5d
Thin-Layer Chromatography Rf = 0.30 (ethyl acetate/n-hexane, 1:9)
Wiley ID 1869472