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(1Z,3R*,5R*,6R*,7R*)-3,6,8-Triacetoxy-3,5,7-trimethyl-1-phenyloct-1-ene

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

(1Z,3R*,5R*,6R*,7R*)-3,6,8-Triacetoxy-3,5,7-trimethyl-1-phenyloct-1-ene
SpectraBase Compound ID EFQ0SfoDtzu
InChI InChI=1S/C23H32O6/c1-16(22(28-19(4)25)17(2)15-27-18(3)24)14-23(6,29-20(5)26)13-12-21-10-8-7-9-11-21/h7-13,16-17,22H,14-15H2,1-6H3/b13-12-/t16-,17-,22-,23+/m1/s1
InChIKey OZAPYSVQNRYXNX-MJDZMFKMSA-N
Mol Weight 404.5 g/mol
Molecular Formula C23H32O6
Exact Mass 404.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KS0E2xuhWON
Name (1Z,3R*,5R*,6R*,7R*)-3,6,8-Triacetoxy-3,5,7-trimethyl-1-phenyloct-1-ene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.219888744 u
Formula C23H32O6
InChI InChI=1S/C23H32O6/c1-16(22(28-19(4)25)17(2)15-27-18(3)24)14-23(6,29-20(5)26)13-12-21-10-8-7-9-11-21/h7-13,16-17,22H,14-15H2,1-6H3/b13-12-/t16-,17-,22-,23+/m1/s1
InChIKey OZAPYSVQNRYXNX-MJDZMFKMSA-N
Molecular Weight 404.503 g/mol
SMILES [C@](OC(=O)C)([C@@](C[C@](\C=C/C1=CC=CC=C1)(OC(=O)C)C)(C)[H])([C@@](COC(=O)C)(C)[H])[H]