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2,4,6-Tris(dec-9-enyl)-1,3,5-trioxane

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2,4,6-Tris(dec-9-enyl)-1,3,5-trioxane
SpectraBase Compound ID Gg2ZDlPOQKX
InChI InChI=1S/C33H60O3/c1-4-7-10-13-16-19-22-25-28-31-34-32(29-26-23-20-17-14-11-8-5-2)36-33(35-31)30-27-24-21-18-15-12-9-6-3/h4-6,31-33H,1-3,7-30H2
InChIKey RVPHQGACPRARCB-UHFFFAOYSA-N
Mol Weight 504.8 g/mol
Molecular Formula C33H60O3
Exact Mass 504.454246 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BEIa9iJrCi6
Name 2,4,6-Tris(dec-9-enyl)-1,3,5-trioxane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 504.454245789 u
Formula C33H60O3
InChI InChI=1S/C33H60O3/c1-4-7-10-13-16-19-22-25-28-31-34-32(29-26-23-20-17-14-11-8-5-2)36-33(35-31)30-27-24-21-18-15-12-9-6-3/h4-6,31-33H,1-3,7-30H2
InChIKey RVPHQGACPRARCB-UHFFFAOYSA-N
Molecular Weight 504.840 g/mol
SMILES C1(OC(OC(O1)CCCCCCCCC=C)CCCCCCCCC=C)CCCCCCCCC=C