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Vanillin acetate
SpectraBase Compound ID L5iw9dkCspK
InChI InChI=1S/C10H10O4/c1-7(12)14-9-4-3-8(6-11)5-10(9)13-2/h3-6H,1-2H3
InChIKey PZSJOBKRSVRODF-UHFFFAOYSA-N
Mol Weight 194.19 g/mol
Molecular Formula C10H10O4
Exact Mass 194.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LpWVGbPDFWn
Name Vanillin AC
Classification Flavor
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Exact Mass 194.057908798 u
Formula C10H10O4
InChI InChI=1S/C10H10O4/c1-7(12)14-9-4-3-8(6-11)5-10(9)13-2/h3-6H,1-2H3
InChIKey PZSJOBKRSVRODF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 194.186 g/mol
SMILES c1c(C=O)cc(c(OC(=O)C)c1)OC
SPLASH splash10-0udi-2900000000-e076e1a1b7b869904426
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
Technique GC/MS
Wiley ID MMPW6e_1973