(1'S,2'S,3'R,4'S)-2'-ethenyl-3'-[(4-methoxyphenyl)methoxy]-2'-spiro[1,3-dioxolane-2,5'-bicyclo[2.2.2]octane]ol

SpectraBase Compound ID	LUbW9PT4Ytx
InChI	InChI=1S/C20H26O5/c1-3-19(21)15-6-9-17(20(12-15)24-10-11-25-20)18(19)23-13-14-4-7-16(22-2)8-5-14/h3-5,7-8,15,17-18,21H,1,6,9-13H2,2H3/t15-,17-,18+,19-/m0/s1
InChIKey	JWYFKWUKRUCBAZ-KANFNMMFSA-N Google Search
Mol Weight	346.42 g/mol
Molecular Formula	C20H26O5
Exact Mass	346.178024 g/mol

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SpectraBase Spectrum ID	L6Q1KmAzcI9
Name	(1'S,2'S,3'R,4'S)-2'-Ethenyl-3'-[(4-methoxyphenyl)methoxy]-2'-spiro[1,3-dioxolane-2,5'-bicyclo[2.2.2]octane]ol
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	346.178023932 u
Formula	C20H26O5
InChI	InChI=1S/C20H26O5/c1-3-19(21)15-6-9-17(20(12-15)24-10-11-25-20)18(19)23-13-14-4-7-16(22-2)8-5-14/h3-5,7-8,15,17-18,21H,1,6,9-13H2,2H3/t15-,17-,18+,19-/m0/s1
InChIKey	JWYFKWUKRUCBAZ-KANFNMMFSA-N
Molecular Weight	346.423 g/mol
SMILES	C12([C@@]3([C@@](OCC4=CC=C(C=C4)OC)([C@@]([C@](C1)(CC3)[H])(C=C)O)[H])[H])OCCO2
Spectrum/Structure Validation Score (Vapor Phase IR)	0.83211