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Umbelliferone PFP             @
SpectraBase Compound ID Ia1Im7gOa2x
InChI InChI=1S/C12H5F5O4/c13-11(14,12(15,16)17)10(19)20-7-3-1-6-2-4-9(18)21-8(6)5-7/h1-5H
InChIKey BWVQHTGQOOSBMS-UHFFFAOYSA-N
Mol Weight 308.16 g/mol
Molecular Formula C12H5F5O4
Exact Mass 308.010799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Omp1LCsu8
Name Umbelliferone PFP @
Classification Fluorescence indic. Flavor
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Exact Mass 308.010799452 u
Formula C12H5O4F5
InChI InChI=1S/C12H5F5O4/c13-11(14,12(15,16)17)10(19)20-7-3-1-6-2-4-9(18)21-8(6)5-7/h1-5H
InChIKey BWVQHTGQOOSBMS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 308.160 g/mol
SMILES c1(OC(=O)C(F)(F)C(F)(F)F)ccc2c(c1)OC(=O)C=C2
SPLASH splash10-0a59-3759000000-549bcd20943fe085189f
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.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Coumarin-M (HO-) PFP
Technique GC/MS
Wiley ID MMPW6e_7613