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6-(benzenesulfinyl)benzocycloheptene-1,4,7-trione
SpectraBase Compound ID 2JcSDbhTRf3
InChI InChI=1S/C17H10O4S/c18-14-8-9-15(19)13-10-17(16(20)7-6-12(13)14)22(21)11-4-2-1-3-5-11/h1-10H
InChIKey JEGSPUDLGQMFKN-UHFFFAOYSA-N
Mol Weight 310.32 g/mol
Molecular Formula C17H10O4S
Exact Mass 310.02998 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7eESGKsiAeq
Name 6-(benzenesulfinyl)benzocycloheptene-1,4,7-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10O4S
InChI InChI=1S/C17H10O4S/c18-14-8-9-15(19)13-10-17(16(20)7-6-12(13)14)22(21)11-4-2-1-3-5-11/h1-10H
InChIKey JEGSPUDLGQMFKN-UHFFFAOYSA-N
Molecular Weight 310.323 g/mol
SMILES C1(=CC2=C(C(=O)C=CC2=O)C=CC1=O)S(=O)c1ccccc1
SPLASH splash10-002b-9312000000-57c19dfd87857ecbc299
Source of Spectrum KC-0-1375-27
Synonyms 6-(benzenesulfinyl)benzo[7]annulene-1,4,7-trione 6-(Phenylsulfinyl)benzo[7]annulene-1,4,7-trione
Wiley ID 821522