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Phloroglucinol triacetate
SpectraBase Compound ID D1sYlmRGGzs
InChI InChI=1S/C12H12O6/c1-7(13)16-10-4-11(17-8(2)14)6-12(5-10)18-9(3)15/h4-6H,1-3H3
InChIKey CLWKAMVDWLTMKD-UHFFFAOYSA-N
Mol Weight 252.22 g/mol
Molecular Formula C12H12O6
Exact Mass 252.063388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HkV9DLDI0OL
Name Phloroglucinol 3AC
Classification Antispasmotic
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Exact Mass 252.063388100 u
Formula C12H12O6
InChI InChI=1S/C12H12O6/c1-7(13)16-10-4-11(17-8(2)14)6-12(5-10)18-9(3)15/h4-6H,1-3H3
InChIKey CLWKAMVDWLTMKD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 252.222 g/mol
Related CAS Registry Number(s) 613-03-6
SMILES c1(cc(OC(=O)C)cc(c1)OC(=O)C)OC(=O)C
SPLASH splash10-004i-2900000000-5071661d72d962035ac8
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
Technique GC/MS
Wiley ID MMPW6e_5634