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1-Benzoxepin-3,5(2H,4H)-dione
SpectraBase Compound ID 3GTY3js3Mcf
InChI InChI=1S/C10H8O3/c11-7-5-9(12)8-3-1-2-4-10(8)13-6-7/h1-4H,5-6H2
InChIKey VXHBBPNYWKGNHL-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C10H8O3
Exact Mass 176.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CK4o9jFdOak
Name 1-Benzoxepin-3,5(2H,4H)-dione
Alternate Name(s) 1-Benzoxepin-3,5-dione 1-Benzoxepin-3,5-quinone 1-Benzoxepine-3,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8O3
InChI InChI=1S/C10H8O3/c11-7-5-9(12)8-3-1-2-4-10(8)13-6-7/h1-4H,5-6H2
InChIKey VXHBBPNYWKGNHL-UHFFFAOYSA-N
Molecular Weight 176.171 g/mol
SMILES C1Oc2c(C(CC1=O)=O)cccc2
SPLASH splash10-056r-3900000000-e856e565d18d84edbf51
Source of Spectrum SO-1977-62-7
Wiley ID 1536992