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4-Oxatricyclo[20.8.0.0(7,16)]triaconta-1(20),7(16)-diene

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4-Oxatricyclo[20.8.0.0(7,16)]triaconta-1(20),7(16)-diene
SpectraBase Compound ID 9uBZkeJ8B8t
InChI InChI=1S/C29H50O/c1-3-7-12-20-28-22-24-30-25-23-29-21-13-8-4-2-6-11-17-27(29)19-15-9-14-18-26(28)16-10-5-1/h1-25H2/b28-26-,29-27-
InChIKey UFRGDVPZWUEGQG-UKDOXLPISA-N
Mol Weight 414.7 g/mol
Molecular Formula C29H50O
Exact Mass 414.386166 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JN40yV4ZTbY
Name 4-Oxatricyclo[20.8.0.0(7,16)]triaconta-1(20),7(16)-diene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.386166229 u
Formula C29H50O
InChI InChI=1S/C29H50O/c1-3-7-12-20-28-22-24-30-25-23-29-21-13-8-4-2-6-11-17-27(29)19-15-9-14-18-26(28)16-10-5-1/h1-25H2/b28-26-,29-27-
InChIKey UFRGDVPZWUEGQG-UKDOXLPISA-N
Molecular Weight 414.718 g/mol
SMILES C1CCCCC\C2=C/(CC1)CCCCC\C=1CCCCCCCCC/1CCOCC2