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BENZO-KETOLACTONE
SpectraBase Compound ID 6kaRxSqWMxd
InChI InChI=1S/C13H14O3/c14-11-6-2-4-8-13(15)16-12-7-3-1-5-10(12)9-11/h1,3,5,7H,2,4,6,8-9H2
InChIKey NWWQBOWBJPXIFD-UHFFFAOYSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G1vPOo9iXBM
Name 2H-1-BENZOXECIN-2,7(8H)-DIONE, 3,4,5,6-TETRAHYDRO-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c14-11-6-2-4-8-13(15)16-12-7-3-1-5-10(12)9-11/h1,3,5,7H,2,4,6,8-9H2
InChIKey NWWQBOWBJPXIFD-UHFFFAOYSA-N
Molecular Weight 218.0939
SMILES c1cc2OC(=O)CCCCC(=O)Cc2cc1
SPLASH splash10-0a4i-9510000000-2ac6bf8817d09f60cd54
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany