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Phenytoin 2TMS
SpectraBase Compound ID IzTc7UjkycP
InChI InChI=1S/C21H28N2O2Si2/c1-26(2,3)22-19(24)21(17-13-9-7-10-14-17,18-15-11-8-12-16-18)23(20(22)25)27(4,5)6/h7-16H,1-6H3
InChIKey FBXVMNWJCVYLIN-UHFFFAOYSA-N
Mol Weight 396.64 g/mol
Molecular Formula C21H28N2O2Si2
Exact Mass 396.168931 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8Hjn5IFTEm
Name Phenytoin 2TMS
CAS Registry Number 63435-72-3
Classification Anticonvulsant
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Exact Mass 396.168931218 u
Formula C21H28N2O2Si2
InChI InChI=1S/C21H28N2O2Si2/c1-26(2,3)22-19(24)21(17-13-9-7-10-14-17,18-15-11-8-12-16-18)23(20(22)25)27(4,5)6/h7-16H,1-6H3
InChIKey FBXVMNWJCVYLIN-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 396.637 g/mol
SMILES C1(N(C(=O)C(N1[Si](C)(C)C)(c1ccccc1)c1ccccc1)[Si](C)(C)C)=O
SPLASH splash10-0g1i-4960000000-c3d09c305b97af93668b
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_4585