(4R)-4-[(E)-4-methoxy-3-methyl-but-3-enyl]-2,2-dimethyl-4-non-1-ynyl-1,3-dioxolane

SpectraBase Compound ID	18XV6WHZSED
InChI	InChI=1S/C20H34O3/c1-6-7-8-9-10-11-12-14-20(15-13-18(2)16-21-5)17-22-19(3,4)23-20/h16H,6-11,13,15,17H2,1-5H3/b18-16+/t20-/m0/s1
InChIKey	LOJGYNNGQIWEOB-IETCZJMGSA-N Google Search
Mol Weight	322.5 g/mol
Molecular Formula	C20H34O3
Exact Mass	322.250795 g/mol

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SpectraBase Spectrum ID	KK4IMklnjac
Name	(4R)-4-[(E)-4-Methoxy-3-methyl-but-3-enyl]-2,2-dimethyl-4-non-1-ynyl-1,3-dioxolane
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	322.250794952 u
Formula	C20H34O3
InChI	InChI=1S/C20H34O3/c1-6-7-8-9-10-11-12-14-20(15-13-18(2)16-21-5)17-22-19(3,4)23-20/h16H,6-11,13,15,17H2,1-5H3/b18-16+/t20-/m0/s1
InChIKey	LOJGYNNGQIWEOB-IETCZJMGSA-N
Molecular Weight	322.489 g/mol
SMILES	C1(O[C@@](C#CCCCCCCC)(CC\C(=C\OC)C)CO1)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR)	0.959775