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(1'S,1R,2S,4S,5S)-2-(1'-Phenylethoxy)-8-oxa-bicyclo[3.2.1]oct-6-en-3-one-4-yl)pivaloate

View entire compound with spectra: 2 MS (GC)

(1'S,1R,2S,4S,5S)-2-(1'-Phenylethoxy)-8-oxa-bicyclo[3.2.1]oct-6-en-3-one-4-yl)pivaloate
SpectraBase Compound ID 1Vsl2szDsi3
InChI InChI=1S/C20H24O5/c1-12(13-8-6-5-7-9-13)23-17-14-10-11-15(24-14)18(16(17)21)25-19(22)20(2,3)4/h5-12,14-15,17-18H,1-4H3/t12?,14-,15+,17?,18-/m0/s1
InChIKey MSYAHMNRXYDLIU-UHFFFAOYSA-N
Mol Weight 344.41 g/mol
Molecular Formula C20H24O5
Exact Mass 344.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4kCe3xWMGVa
Name (1'S,1R,2S,4S,5S)-2-(1'-Phenylethoxy)-8-oxa-bicyclo[3.2.1]oct-6-en-3-one-4-yl)pivaloate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O5
InChI InChI=1S/C20H24O5/c1-12(13-8-6-5-7-9-13)23-17-14-10-11-15(24-14)18(16(17)21)25-19(22)20(2,3)4/h5-12,14-15,17-18H,1-4H3/t12?,14-,15+,17?,18-/m0/s1
InChIKey MSYAHMNRXYDLIU-UHFFFAOYSA-N
Molecular Weight 344.407 g/mol
SMILES C1([C@@](OC(C(C)(C)C)=O)([C@]2(C=C[C@](O2)(C1OC(c1ccccc1)C)[H])[H])[H])=O
SPLASH splash10-0a4r-1900000000-2fba1dd43f80345f6336
Source of Spectrum QE-7-4786-16
Synonyms (1'S,1R,2S,5S)-2-(1'-Phenylethoxy)-8-oxabicyclo[3.2.1]octa-6-ene-3-one-4-yl)pivaloate
Wiley ID 846117