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7-Chloro-4-iodo-3-phenoxy-2-methyl-2H-benz[b]oxepine-5-one
SpectraBase Compound ID FrbjagupbPd
InChI InChI=1S/C17H12ClIO3/c1-10-17(22-12-5-3-2-4-6-12)15(19)16(20)13-9-11(18)7-8-14(13)21-10/h2-10H,1H3
InChIKey WEXZMGRFHYNWEU-UHFFFAOYSA-N
Mol Weight 426.64 g/mol
Molecular Formula C17H12ClIO3
Exact Mass 425.951967 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LhnS81KuCX
Name 7-Chloro-4-iodo-3-phenoxy-2-methyl-2H-benz[b]oxepine-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12ClIO3
InChI InChI=1S/C17H12ClIO3/c1-10-17(22-12-5-3-2-4-6-12)15(19)16(20)13-9-11(18)7-8-14(13)21-10/h2-10H,1H3
InChIKey WEXZMGRFHYNWEU-UHFFFAOYSA-N
Molecular Weight 426.637 g/mol
SMILES C1(=C(C(Oc2c(C1=O)cc(cc2)Cl)C)Oc1ccccc1)I
SPLASH splash10-003s-6439200000-228eb6a6b02d968bebec
Source of Spectrum J-58-4888-6b
Wiley ID 1380323