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5-delta-hydroxybutyl hydantoin, 3TMS
SpectraBase Compound ID 6kB4MRrUMYF
InChI InChI=1S/C16H36N2O3Si3/c1-22(2,3)17-14(12-10-11-13-21-24(7,8)9)15(19)18(16(17)20)23(4,5)6/h14H,10-13H2,1-9H3
InChIKey PDJDGRUKPMVBGH-UHFFFAOYSA-N
Mol Weight 388.7 g/mol
Molecular Formula C16H36N2O3Si3
Exact Mass 388.203373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4TKknFyQwS
Name 5-delta-hydroxybutyl hydantoin, 3TMS
Comments Derivatization type: 3 TMS (mass: 388.203); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib001061; Note: The molecular formula of the structure shown is C7H12N2O3 - which differs from the formula reported for the mass spectrum (C16H36N2O3Si3)
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Formula C16H36N2O3Si3
InChI InChI=1S/C16H36N2O3Si3/c1-22(2,3)17-14(12-10-11-13-21-24(7,8)9)15(19)18(16(17)20)23(4,5)6/h14H,10-13H2,1-9H3
InChIKey PDJDGRUKPMVBGH-UHFFFAOYSA-N
Molecular Weight 388.730 g/mol
SMILES C(CCO[Si](C)(C)C)CC1C(N(C(N1[Si](C)(C)C)=O)[Si](C)(C)C)=O
SPLASH splash10-0a4i-0972000000-5fadab3727967be8cd8c
Source of Spectrum FM-2019-1061-0
Synonyms NSC16534, 3TMS 5-(.epsilon.-Hydroxybutyl)hydantoin, 3TMS Hydantoin, 5-(4-hydroxybutyl)-, 3TMS AIDS056856, 3TMS Hydantoin, 5- (4-hydroxybutyl)-, 3TMS AIDS-056856, 3TMS 5-(4-hydroxybutyl)imidazolidine-2,4-dione, 3TMS 1,3-bis(trimethylsilyl)-5-(4-((trimethylsilyl)oxy)butyl)imidazolidine-2,4-dione
Wiley ID 1818719