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7,9-Dichloro-2H-1-benzoxepin-5-one
SpectraBase Compound ID KEf8rTjiDOG
InChI InChI=1S/C10H6Cl2O2/c11-6-4-7-9(13)2-1-3-14-10(7)8(12)5-6/h1-2,4-5H,3H2
InChIKey QMGYLCCRLRXBIV-UHFFFAOYSA-N
Mol Weight 229.06 g/mol
Molecular Formula C10H6Cl2O2
Exact Mass 227.974485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KAgczQe8w1L
Name 7,9-Dichloro-2H-1-benzoxepin-5-one
Appearance Colorless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H6Cl2O2
InChI InChI=1S/C10H6Cl2O2/c11-6-4-7-9(13)2-1-3-14-10(7)8(12)5-6/h1-2,4-5H,3H2
InChIKey QMGYLCCRLRXBIV-UHFFFAOYSA-N
Instrument Name Hewlett Packard series II
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.219
Molecular Weight 229.062 g/mol
Reported Formula C10H6Cl2O2
SMILES C1Oc2c(C(C=C1)=O)cc(cc2Cl)Cl
SPLASH splash10-0f92-0980000000-8f158e522aac20520ee4
Source of Spectrum ARK-2008-180-5e
Thin-Layer Chromatography Rf = 0.39 (ethyl acetate/n-hexane, 1:9)
Wiley ID 1869473