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Phenytoin-M (HO-) (ME)2AC
SpectraBase Compound ID 921D9kQxxLq
InChI InChI=1S/C20H18N2O5/c1-13(23)22-19(26)21(3)18(25)20(22,15-7-5-4-6-8-15)16-9-11-17(12-10-16)27-14(2)24/h4-12H,1-3H3
InChIKey IVBPNEZUNZLGIM-UHFFFAOYSA-N
Mol Weight 366.37 g/mol
Molecular Formula C20H18N2O5
Exact Mass 366.121572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57ke4r6sZE
Name Phenytoin-M (HO-) (ME)2AC
Classification Anticonvulsant
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 366.121571683 u
Formula C20H18N2O5
InChI InChI=1S/C20H18N2O5/c1-13(23)22-19(26)21(3)18(25)20(22,15-7-5-4-6-8-15)16-9-11-17(12-10-16)27-14(2)24/h4-12H,1-3H3
InChIKey IVBPNEZUNZLGIM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 366.373 g/mol
SMILES CC(Oc1ccc(C2(C(=O)N(C(=O)N2C(=O)C)C)c2ccccc2)cc1)=O
SPLASH splash10-00di-0389000000-ef47fcf37a9b8f508105
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: U+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_872