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2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-phenyl-
SpectraBase Compound ID 9iQ2EFKVVZM
InChI InChI=1S/C12H17NO3Si/c1-2-4-12(5-3-1)17-14-9-6-13(7-10-15-17)8-11-16-17/h1-5H,6-11H2
InChIKey IJOIPPSHQCEBDH-UHFFFAOYSA-N
Mol Weight 251.36 g/mol
Molecular Formula C12H17NO3Si
Exact Mass 251.09777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGaHbyyPP5k
Name Phenylsilatrane
CAS Registry Number 2097-19-0
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 251.097769943 u
Formula C12H17NO3Si
InChI InChI=1S/C12H17NO3Si/c1-2-4-12(5-3-1)17-14-9-6-13(7-10-15-17)8-11-16-17/h1-5H,6-11H2
InChIKey IJOIPPSHQCEBDH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 251.357 g/mol
Nominal Mass 251 u
Quality 945
Retention Index 1913
SMILES C=1([Si]23OCCN(CCO3)CCO2)C=CC=CC1
SPLASH splash10-00di-3900000000-5f40072c114dff842519
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane,1-phenyl
Technique GC/MS
Wiley ID DD2024_024946