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Benzilic acid, methyl ester
SpectraBase Compound ID ETs6O6PRQyr
InChI InChI=1S/C15H14O3/c1-18-14(16)15(17,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,17H,1H3
InChIKey LJFIHTFNTGQZJL-UHFFFAOYSA-N
Mol Weight 242.27 g/mol
Molecular Formula C15H14O3
Exact Mass 242.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lmmui5E5Vbi
Name Benactyzine-M (HOOC-) ME @
Classification Sedative
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Exact Mass 242.094294308 u
Formula C15H14O3
InChI InChI=1S/C15H14O3/c1-18-14(16)15(17,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,17H,1H3
InChIKey LJFIHTFNTGQZJL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 242.274 g/mol
SMILES c1cc(ccc1)C(C(OC)=O)(O)c1ccccc1
SPLASH splash10-0560-5900000000-79544b1b38e0f6a06ed5
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 Benzilic acid ME
Technique GC/MS
Wiley ID MMPW6e_78