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6,7-OXIDOSQUALENE

View entire compound with spectra: 2 NMR

6,7-OXIDOSQUALENE
SpectraBase Compound ID LNjQ2dcSZq8
InChI InChI=1S/C30H50O/c1-24(2)14-11-18-27(6)20-12-19-26(5)16-9-10-17-28(7)21-22-29-30(8,31-29)23-13-15-25(3)4/h14-17,20,29H,9-13,18-19,21-23H2,1-8H3/b26-16+,27-20+,28-17+
InChIKey ZBGRMKZSJNJFTN-HKWLGGFDSA-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 2sPPuGVZJpj
Name 6,7-OXIDOSQUALENE
Compound Number 2
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)14-11-18-27(6)20-12-19-26(5)16-9-10-17-28(7)21-22-29-30(8,31-29)23-13-15-25(3)4/h14-17,20,29H,9-13,18-19,21-23H2,1-8H3/b26-16+,27-20+,28-17+
InChIKey ZBGRMKZSJNJFTN-HKWLGGFDSA-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 UWRU952