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(2S,5R,1'S)-2-(tert-butyl)-5-phenyl-5-(1'-phenyl-1'-hydroxymethyl)-1,3-dioxolane-4-one
SpectraBase Compound ID LZquOxa9VJM
InChI InChI=1S/C20H22O4/c1-19(2,3)18-23-17(22)20(24-18,15-12-8-5-9-13-15)16(21)14-10-6-4-7-11-14/h4-13,16,18,21H,1-3H3/t16-,18+,20+/m0/s1
InChIKey SFLRMDJICXEEMM-ILZDJORESA-N
Mol Weight 326.39 g/mol
Molecular Formula C20H22O4
Exact Mass 326.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kf5cCPvzwXR
Name (2S,5R,1'S)-2-(tert-butyl)-5-phenyl-5-(1'-phenyl-1'-hydroxymethyl)-1,3-dioxolane-4-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O4
InChI InChI=1S/C20H22O4/c1-19(2,3)18-23-17(22)20(24-18,15-12-8-5-9-13-15)16(21)14-10-6-4-7-11-14/h4-13,16,18,21H,1-3H3/t16-,18+,20+/m0/s1
InChIKey SFLRMDJICXEEMM-ILZDJORESA-N
Molecular Weight 326.392 g/mol
SMILES O[C@]([C@@]1(C(O[C@](O1)(C(C)(C)C)[H])=O)c1ccccc1)(c1ccccc1)[H]
SPLASH splash10-00di-0090000000-07b0fa5e3f04594467db
Source of Spectrum F-67-885-7aA
Wiley ID 1685514