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6-Acetoxy-coumarin
SpectraBase Compound ID HbwSXbm8gjm
InChI InChI=1S/C11H8O4/c1-7(12)14-9-3-4-10-8(6-9)2-5-11(13)15-10/h2-6H,1H3
InChIKey YJFWQQFBOFHFLX-UHFFFAOYSA-N
Mol Weight 204.18 g/mol
Molecular Formula C11H8O4
Exact Mass 204.042259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LRciP1dcIYY
Name Umbelliferone AC @
Classification Fluorescence indic. Flavor
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 204.042258734 u
Formula C11H8O4
InChI InChI=1S/C11H8O4/c1-7(12)14-9-3-4-10-8(6-9)2-5-11(13)15-10/h2-6H,1H3
InChIKey YJFWQQFBOFHFLX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 204.181 g/mol
SMILES CC(Oc1cc2c(OC(C=C2)=O)cc1)=O
SPLASH splash10-03e9-2900000000-001dc456660179943f9a
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Coumarin-M (HO-) AC
Technique GC/MS
Wiley ID MMPW6e_4367