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Amorfrutin A, 2tms

View entire compound with spectra: 1 NMR

Amorfrutin A, 2tms
SpectraBase Compound ID IFDFH58kyQJ
InChI InChI=1S/C27H40O4Si2/c1-20(2)15-18-23-24(29-3)19-22(17-16-21-13-11-10-12-14-21)25(26(23)30-32(4,5)6)27(28)31-33(7,8)9/h10-15,19H,16-18H2,1-9H3
InChIKey LVRXPWNVLLPGJE-UHFFFAOYSA-N
Mol Weight 484.8 g/mol
Molecular Formula C27H40O4Si2
Exact Mass 484.246513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KzErhFOgGq6
Name Amorfrutin A, 2tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 484.246512834 u
Formula C27H40O4Si2
InChI InChI=1S/C27H40O4Si2/c1-20(2)15-18-23-24(29-3)19-22(17-16-21-13-11-10-12-14-21)25(26(23)30-32(4,5)6)27(28)31-33(7,8)9/h10-15,19H,16-18H2,1-9H3
InChIKey LVRXPWNVLLPGJE-UHFFFAOYSA-N
Molecular Weight 484.783 g/mol
SMILES C(C1=C(C(=C(C=C1CCC1=CC=CC=C1)OC)CC=C(C)C)O[Si](C)(C)C)(=O)O[Si](C)(C)C