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3,6,9,12,15,18,21,24-Octaoxabicyclo[24.4.0]triaconta-1(30),26,28-triene

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3,6,9,12,15,18,21,24-Octaoxabicyclo[24.4.0]triaconta-1(30),26,28-triene
SpectraBase Compound ID J88p9BLOJjF
InChI InChI=1S/C22H36O8/c1-2-4-22-20-30-18-16-28-14-12-26-10-8-24-6-5-23-7-9-25-11-13-27-15-17-29-19-21(22)3-1/h1-4H,5-20H2
InChIKey QXBWFDDOCYWKBA-UHFFFAOYSA-N
Mol Weight 428.5 g/mol
Molecular Formula C22H36O8
Exact Mass 428.241018 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5XoPaizMGd2
Name 3,6,9,12,15,18,21,24-Octaoxabicyclo[24.4.0]triaconta-1(30),26,28-triene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 428.241018111 u
Formula C22H36O8
InChI InChI=1S/C22H36O8/c1-2-4-22-20-30-18-16-28-14-12-26-10-8-24-6-5-23-7-9-25-11-13-27-15-17-29-19-21(22)3-1/h1-4H,5-20H2
InChIKey QXBWFDDOCYWKBA-UHFFFAOYSA-N
Molecular Weight 428.522 g/mol
SMILES C12=C(COCCOCCOCCOCCOCCOCCOCCOC2)C=CC=C1