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Pridinol-M (di-HO-) -H2O 2AC
SpectraBase Compound ID 5JOgcKZ7qyw
InChI InChI=1S/C24H27NO4/c1-18(26)28-22-10-8-21(9-11-22)24(20-6-4-3-5-7-20)14-17-25-15-12-23(13-16-25)29-19(2)27/h3-11,14,23H,12-13,15-17H2,1-2H3/b24-14-
InChIKey IFECMHNGVLOMAA-OYKKKHCWSA-N
Mol Weight 393.48 g/mol
Molecular Formula C24H27NO4
Exact Mass 393.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JgbOfQBaS
Name Pridinol-M (di-HO-) -H2O 2AC
Classification Antiparkinsonian
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 393.194008349 u
Formula C24H27NO4
InChI InChI=1S/C24H27NO4/c1-18(26)28-22-10-8-21(9-11-22)24(20-6-4-3-5-7-20)14-17-25-15-12-23(13-16-25)29-19(2)27/h3-11,14,23H,12-13,15-17H2,1-2H3/b24-14-
InChIKey IFECMHNGVLOMAA-OYKKKHCWSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 393.483 g/mol
SMILES CC(Oc1ccc(\C(c2ccccc2)=C/CN2CCC(CC2)OC(=O)C)cc1)=O
SPLASH splash10-0a4i-5951000000-24437c769b4e69ea631d
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_1289