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(5S,10Z,11Ar)-5-(acetyloxy)-6,10-bis(hydroxymethyl)-3-methylidene-2-oxo-2,3,3A,4,5,8,9,11A-octahydrocyclodeca[B]furan-4-yl 2-methylbutanoate, 2tms derivative

View entire compound with spectra: 1 NMR

(5S,10Z,11Ar)-5-(acetyloxy)-6,10-bis(hydroxymethyl)-3-methylidene-2-oxo-2,3,3A,4,5,8,9,11A-octahydrocyclodeca[B]furan-4-yl 2-methylbutanoate, 2tms derivative
SpectraBase Compound ID 1ZIFO8Wb0Rf
InChI InChI=1S/C28H46O8Si2/c1-11-18(2)27(30)36-26-24-19(3)28(31)35-23(24)15-21(16-32-37(5,6)7)13-12-14-22(17-33-38(8,9)10)25(26)34-20(4)29/h14-15,18,23-26H,3,11-13,16-17H2,1-2,4-10H3/b21-15-,22-14+/t18?,23-,24?,25+,26?/m1/s1
InChIKey QQDPUSFVKWJERS-LJQFADLNSA-N
Mol Weight 566.8 g/mol
Molecular Formula C28H46O8Si2
Exact Mass 566.273122 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4CNFllrlDAx
Name (5S,10Z,11Ar)-5-(acetyloxy)-6,10-bis(hydroxymethyl)-3-methylidene-2-oxo-2,3,3A,4,5,8,9,11A-octahydrocyclodeca[B]furan-4-yl 2-methylbutanoate, 2tms derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 566.273121503 u
Formula C28H46O8Si2
InChI InChI=1S/C28H46O8Si2/c1-11-18(2)27(30)36-26-24-19(3)28(31)35-23(24)15-21(16-32-37(5,6)7)13-12-14-22(17-33-38(8,9)10)25(26)34-20(4)29/h14-15,18,23-26H,3,11-13,16-17H2,1-2,4-10H3/b21-15-,22-14+/t18?,23-,24?,25+,26?/m1/s1
InChIKey QQDPUSFVKWJERS-LJQFADLNSA-N
Molecular Weight 566.838 g/mol
SMILES C(C(CC)C)(=O)OC1[C@](\C(=C\CC\C(=C\[C@]2(OC(=O)C(C12)=C)[H])CO[Si](C)(C)C)CO[Si](C)(C)C)(OC(=O)C)[H]