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Styracitol tetrabenzoate

View entire compound with spectra: 1 NMR

Styracitol tetrabenzoate
SpectraBase Compound ID 7wPo9d92r8
InChI InChI=1S/C34H28O9/c35-31(23-13-5-1-6-14-23)40-21-27-29(42-33(37)25-17-9-3-10-18-25)30(43-34(38)26-19-11-4-12-20-26)28(22-39-27)41-32(36)24-15-7-2-8-16-24/h1-20,27-30H,21-22H2
InChIKey SLUHAFOOXFMQRA-UHFFFAOYSA-N
Mol Weight 580.6 g/mol
Molecular Formula C34H28O9
Exact Mass 580.173332 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5dmKVM4jEPB
Name Styracitol tetrabenzoate
Comments Computed using HOSE algorithm
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Exact Mass 580.173332473 u
Formula C34H28O9
InChI InChI=1S/C34H28O9/c35-31(23-13-5-1-6-14-23)40-21-27-29(42-33(37)25-17-9-3-10-18-25)30(43-34(38)26-19-11-4-12-20-26)28(22-39-27)41-32(36)24-15-7-2-8-16-24/h1-20,27-30H,21-22H2
InChIKey SLUHAFOOXFMQRA-UHFFFAOYSA-N
Molecular Weight 580.589 g/mol
SMILES [C@@]1([C@](OC[C@]([C@]1(OC(=O)C1=CC=CC=C1)[H])(OC(=O)C1=CC=CC=C1)[H])(COC(=O)C1=CC=CC=C1)[H])(OC(=O)C1=CC=CC=C1)[H]