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2,3-EPOXY-2,3-DIHYDRO-SQUALENE

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2,3-EPOXY-2,3-DIHYDRO-SQUALENE
SpectraBase Compound ID AjQzJjOOTZo
InChI InChI=1S/C30H50O/c1-24(2)14-11-17-27(5)20-12-18-25(3)15-9-10-16-26(4)19-13-21-28(6)22-23-29-30(7,8)31-29/h14-16,20-21,29H,9-13,17-19,22-23H2,1-8H3/b25-15+,26-16+,27-20+,28-21+
InChIKey QYIMSPSDBYKPPY-BANQPHDMSA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C1r1BjXtu2j
Name (3S)-2,3-OXIDOSQUALENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-24(2)14-11-17-27(5)20-12-18-25(3)15-9-10-16-26(4)19-13-21-28(6)22-23-29-30(7,8)31-29/h14-16,20-21,29H,9-13,17-19,22-23H2,1-8H3/b25-15+,26-16+,27-20+,28-21+
InChIKey QYIMSPSDBYKPPY-BANQPHDMSA-N
Literature Reference Author J.L.ABAD,J.CASAS,F.SANCHEZ-BAEZA,A.MESSEGUER
Literature Reference Citation J.ORG.CHEM.,58,3991(1993)
Literature Reference DOI 10.1021/jo00067a036
Molecular Weight 426.726 g/mol
Solvent CDCl3
Source File Reference UWRU951