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trans-2-(1,1-Dimethylethyl)-3-phenyl-5-(iodomethyl)isoxazolidine
SpectraBase Compound ID 88PkQfnl9Gc
InChI InChI=1S/C14H20INO/c1-14(2,3)16-13(9-12(10-15)17-16)11-7-5-4-6-8-11/h4-8,12-13H,9-10H2,1-3H3/t12-,13-/m0/s1
InChIKey VYLRXVZWDSXSFB-STQMWFEESA-N
Mol Weight 345.22 g/mol
Molecular Formula C14H20INO
Exact Mass 345.058959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BrCXmYTBHax
Name trans-2-(1,1-Dimethylethyl)-3-phenyl-5-(iodomethyl)isoxazolidine
Alternate Name(s) (3S,5S)-2-tert-butyl-5-(iodomethyl)-3-phenylisoxazolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20INO
InChI InChI=1S/C14H20INO/c1-14(2,3)16-13(9-12(10-15)17-16)11-7-5-4-6-8-11/h4-8,12-13H,9-10H2,1-3H3/t12-,13-/m0/s1
InChIKey VYLRXVZWDSXSFB-STQMWFEESA-N
Molecular Weight 345.224 g/mol
SMILES [C@]1(N(O[C@@](C1)(CI)[H])C(C)(C)C)(c1ccccc1)[H]
SPLASH splash10-08ni-5931000000-310f3af6fe1d78075484
Source of Spectrum J-56-4251-4
Wiley ID 1338501