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(2R,3R,6R,7S,9R,10S)-6,7:9,10-Diepoxy-2,3-diphenyl-1,4-dioxaspiro[4.5]decan-8-one
SpectraBase Compound ID D4EQ8hDVfCM
InChI InChI=1S/C20H16O5/c21-13-16-18(22-16)20(19-17(13)23-19)24-14(11-7-3-1-4-8-11)15(25-20)12-9-5-2-6-10-12/h1-10,14-19H/t14-,15?,16-,17+,18-,19+,20+/m1/s1
InChIKey YNORTJJYGMDSRX-XMXBIACMSA-N
Mol Weight 336.34 g/mol
Molecular Formula C20H16O5
Exact Mass 336.099774 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CGEc5JYOtNF
Name (2R,3R,6R,7S,9R,10S)-6,7:9,10-Diepoxy-2,3-diphenyl-1,4-dioxaspiro[4.5]decan-8-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.099773610 u
Formula C20H16O5
InChI InChI=1S/C20H16O5/c21-13-16-18(22-16)20(19-17(13)23-19)24-14(11-7-3-1-4-8-11)15(25-20)12-9-5-2-6-10-12/h1-10,14-19H/t14-,15?,16-,17+,18-,19+,20+/m1/s1
InChIKey YNORTJJYGMDSRX-XMXBIACMSA-N
Molecular Weight 336.343 g/mol
SMILES [C@]12([C@@]3([C@@](O3)(C([C@@]3([C@]1(O3)[H])[H])=O)[H])[H])O[C@](C=1C=CC=CC1)(C(O2)C1=CC=CC=C1)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.91795