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cis-5-(6-(1,3-Dithian-2-yl)hexyl)-trans-4-formyl-2,ref.-3-diphenylisoxazolidine
SpectraBase Compound ID GxdVl4eUV8r
InChI InChI=1S/C26H33NO2S2/c28-20-23-24(16-9-1-2-10-17-25-30-18-11-19-31-25)29-27(22-14-7-4-8-15-22)26(23)21-12-5-3-6-13-21/h3-8,12-15,20,23-26H,1-2,9-11,16-19H2
InChIKey XOMYPXJYUMGVJZ-UHFFFAOYSA-N
Mol Weight 455.7 g/mol
Molecular Formula C26H33NO2S2
Exact Mass 455.195272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2cHql0K4nI
Name cis-5-(6-(1,3-Dithian-2-yl)hexyl)-trans-4-formyl-2,ref.-3-diphenylisoxazolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H33NO2S2
InChI InChI=1S/C26H33NO2S2/c28-20-23-24(16-9-1-2-10-17-25-30-18-11-19-31-25)29-27(22-14-7-4-8-15-22)26(23)21-12-5-3-6-13-21/h3-8,12-15,20,23-26H,1-2,9-11,16-19H2
InChIKey XOMYPXJYUMGVJZ-UHFFFAOYSA-N
Molecular Weight 455.675 g/mol
SMILES c1c(C2N(c3ccccc3)OC(C2C=O)CCCCCCC2SCCCS2)cccc1
SPLASH splash10-0frx-9700400000-39e00343a0e63967cb1a
Source of Spectrum SRH-2022-10271-0
Synonyms (3s,4s,5r)-4-formyl-2,3-diphenyl-5-(6-(1,3-dithian-2-yl)hexyl)isoxazolidine
Wiley ID 1831890