Methyl 13-(benzoylox)-10-[(tetrahydropyranyl)oxy]tridec-11-ene-5,8-diynoate

SpectraBase Compound ID	8rXepkd3nss
InChI	InChI=1S/C26H30O6/c1-29-24(27)18-10-5-3-2-4-9-16-23(32-25-19-11-12-20-30-25)17-13-21-31-26(28)22-14-7-6-8-15-22/h6-8,13-15,17,23,25H,4-5,10-12,18-21H2,1H3/b17-13+
InChIKey	YLTUQPXADXAWPO-GHRIWEEISA-N Google Search
Mol Weight	438.52 g/mol
Molecular Formula	C26H30O6
Exact Mass	438.204239 g/mol

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SpectraBase Spectrum ID	FIZfDafNYjI
Name	Methyl 13-(benzoylox)-10-[(tetrahydropyranyl)oxy]tridec-11-ene-5,8-diynoate
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	438.204238680 u
Formula	C26H30O6
InChI	InChI=1S/C26H30O6/c1-29-24(27)18-10-5-3-2-4-9-16-23(32-25-19-11-12-20-30-25)17-13-21-31-26(28)22-14-7-6-8-15-22/h6-8,13-15,17,23,25H,4-5,10-12,18-21H2,1H3/b17-13+
InChIKey	YLTUQPXADXAWPO-GHRIWEEISA-N
Molecular Weight	438.520 g/mol
SMILES	C(=O)(C1=CC=CC=C1)OC\C=C\C(C#CCC#CCCCC(=O)OC)OC1OCCCC1