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8,9-Dichloro-2-methoxy-5a,6-dihydro-12H-chromeno[2,3-c][1]benzoxepin-12-one
SpectraBase Compound ID BQquImDiKay
InChI InChI=1S/C18H12Cl2O4/c1-22-10-2-5-14-9(6-10)7-12-15(24-14)8-23-18-11(17(12)21)3-4-13(19)16(18)20/h2-7,15H,8H2,1H3
InChIKey ZZDWMPKWBCXJTC-UHFFFAOYSA-N
Mol Weight 363.2 g/mol
Molecular Formula C18H12Cl2O4
Exact Mass 362.011264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 68QCI4YhvRq
Name 8,9-Dichloro-2-methoxy-5a,6-dihydro-12H-chromeno[2,3-c][1]benzoxepin-12-one
Appearance Yellow crystals
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Formula C18H12Cl2O4
InChI InChI=1S/C18H12Cl2O4/c1-22-10-2-5-14-9(6-10)7-12-15(24-14)8-23-18-11(17(12)21)3-4-13(19)16(18)20/h2-7,15H,8H2,1H3
InChIKey ZZDWMPKWBCXJTC-UHFFFAOYSA-N
Instrument Name Hewlett Packard series II
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0014.303
Molecular Weight 363.196 g/mol
Reported Formula C18H12Cl2O4
SMILES c1(Cl)ccc2C(C=3C(COc2c1Cl)Oc1c(C3)cc(cc1)OC)=O
SPLASH splash10-00di-0903000000-2a997689294dcebb9f3d
Source of Spectrum ARK-2013-34-3g
Thin-Layer Chromatography Rf = 0.55 (ethyl acetate/n-hexane, 1:6)
Wiley ID 1853438