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Phenytoin-M (OH) 2AC
SpectraBase Compound ID uyHubbktEy
InChI InChI=1S/C19H16N2O5/c1-12(22)21-17(24)19(20-18(21)25,14-6-4-3-5-7-14)15-8-10-16(11-9-15)26-13(2)23/h3-11H,1-2H3,(H,20,25)
InChIKey FFYCCFZSGHABNE-UHFFFAOYSA-N
Mol Weight 352.35 g/mol
Molecular Formula C19H16N2O5
Exact Mass 352.105922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dm1QP3CFqng
Name Phenytoin-M (OH) 2AC
Classification Pharmaceutical drug metabolite derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 352.105921618 u
Formula C19H16N2O5
InChI InChI=1S/C19H16N2O5/c1-12(22)21-17(24)19(20-18(21)25,14-6-4-3-5-7-14)15-8-10-16(11-9-15)26-13(2)23/h3-11H,1-2H3,(H,20,25)
InChIKey FFYCCFZSGHABNE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 352.346 g/mol
Nominal Mass 352 u
Quality 930
Retention Index 2793
SMILES C1(NC(N(C1=O)C(=O)C)=O)(C1=CC=C(C=C1)OC(=O)C)C1=CC=CC=C1
SPLASH splash10-03k9-2496000000-aca96349b3e990cb2b95
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-(1-acetyl-2,5-dioxo-4-phenylimidazolidin-4-yl)phenyl acetate
Technique GC/MS
Wiley ID DD2024_014273