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Tiruneessin [3-[2-(4-Hydroxy-3-methoxyphenyl)-3-acetoxymethyl-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]propanyl-1-acetate]

View entire compound with spectra: 1 MS (GC)

Tiruneessin [3-[2-(4-Hydroxy-3-methoxyphenyl)-3-acetoxymethyl-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]propanyl-1-acetate]
SpectraBase Compound ID Ds4MuGMcBi1
InChI InChI=1S/C24H28O8/c1-14(25)30-9-5-6-16-10-18-19(13-31-15(2)26)23(32-24(18)22(11-16)29-4)17-7-8-20(27)21(12-17)28-3/h7-8,10-12,19,23,27H,5-6,9,13H2,1-4H3/t19-,23+/m0/s1
InChIKey FYOAKAWRSFNTPT-WMZHIEFXSA-N
Mol Weight 444.48 g/mol
Molecular Formula C24H28O8
Exact Mass 444.178418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JM9nclCoCt
Name Tiruneessin [3-[2-(4-Hydroxy-3-methoxyphenyl)-3-acetoxymethyl-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]propanyl-1-acetate]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28O8
InChI InChI=1S/C24H28O8/c1-14(25)30-9-5-6-16-10-18-19(13-31-15(2)26)23(32-24(18)22(11-16)29-4)17-7-8-20(27)21(12-17)28-3/h7-8,10-12,19,23,27H,5-6,9,13H2,1-4H3/t19-,23+/m0/s1
InChIKey FYOAKAWRSFNTPT-WMZHIEFXSA-N
Molecular Weight 444.480 g/mol
SMILES Oc1ccc([C@@]2([C@](c3c(O2)c(OC)cc(c3)CCCOC(=O)C)(COC(=O)C)[H])[H])cc1OC
SPLASH splash10-001i-0009200000-8c78be8ad1df6f6b1d28
Source of Spectrum Y1-40-598-2
Wiley ID 1564836