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trans-2-(Phenylmethyl)-3-(.alpha.-methylethyl)-5-(iodomethyl)isoxazolidine
SpectraBase Compound ID 5zgS9Zxcrct
InChI InChI=1S/C14H20INO/c1-11(2)14-8-13(9-15)17-16(14)10-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3/t13-,14-/m0/s1
InChIKey RQNSBGFLJLOTHP-KBPBESRZSA-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 GVHhGFFmClL
Name trans-2-(Phenylmethyl)-3-(.alpha.-methylethyl)-5-(iodomethyl)isoxazolidine
Alternate Name(s) (3S,5S)-2-benzyl-5-(iodomethyl)-3-isopropylisoxazolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20INO
InChI InChI=1S/C14H20INO/c1-11(2)14-8-13(9-15)17-16(14)10-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3/t13-,14-/m0/s1
InChIKey RQNSBGFLJLOTHP-KBPBESRZSA-N
Molecular Weight 345.224 g/mol
SMILES [C@]1(ON([C@@](C1)(C(C)C)[H])Cc1ccccc1)(CI)[H]
SPLASH splash10-0f6x-9004000000-a71170c99e15e4bf416b
Source of Spectrum J-56-4251-4
Wiley ID 1338503