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cis-2-(Phenylmethyl)-3-phenyl-5-(iodomethyl)isoxazolidine
SpectraBase Compound ID 5nzSJjPR99G
InChI InChI=1S/C17H18INO/c18-12-16-11-17(15-9-5-2-6-10-15)19(20-16)13-14-7-3-1-4-8-14/h1-10,16-17H,11-13H2/t16-,17+/m1/s1
InChIKey MLCFAQKRVRZSRN-SJORKVTESA-N
Mol Weight 379.24 g/mol
Molecular Formula C17H18INO
Exact Mass 379.043309 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F46GaHx8aBp
Name cis-2-(Phenylmethyl)-3-phenyl-5-(iodomethyl)isoxazolidine
Alternate Name(s) (3S,5R)-2-benzyl-5-(iodomethyl)-3-phenylisoxazolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18INO
InChI InChI=1S/C17H18INO/c18-12-16-11-17(15-9-5-2-6-10-15)19(20-16)13-14-7-3-1-4-8-14/h1-10,16-17H,11-13H2/t16-,17+/m1/s1
InChIKey MLCFAQKRVRZSRN-SJORKVTESA-N
Molecular Weight 379.241 g/mol
SMILES [C@@]1(ON([C@@](C1)(c1ccccc1)[H])Cc1ccccc1)(CI)[H]
SPLASH splash10-000x-9700000000-679636869b2fbfa8e3d8
Source of Spectrum J-56-4251-3
Wiley ID 1359194