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METHYL-2-OCTYL-2-(PHENYLSULFONYL)-DECANOATE

View entire compound with spectra: 1 NMR

METHYL-2-OCTYL-2-(PHENYLSULFONYL)-DECANOATE
SpectraBase Compound ID EgnfaUKdfU4
InChI InChI=1S/C25H42O4S/c1-4-6-8-10-12-17-21-25(24(26)28-3,22-18-13-11-9-7-5-2)30(27)29-23-19-15-14-16-20-23/h14-16,19-20H,4-13,17-18,21-22H2,1-3H3
InChIKey ZDQYCGYZANRJRT-UHFFFAOYSA-N
Mol Weight 438.7 g/mol
Molecular Formula C25H42O4S
Exact Mass 438.280381 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4QazJfmLtBQ
Name METHYL-2-OCTYL-2-(PHENYLSULFONYL)-DECANOATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H42O4S
InChI InChI=1S/C25H42O4S/c1-4-6-8-10-12-17-21-25(24(26)28-3,22-18-13-11-9-7-5-2)30(27)29-23-19-15-14-16-20-23/h14-16,19-20H,4-13,17-18,21-22H2,1-3H3
InChIKey ZDQYCGYZANRJRT-UHFFFAOYSA-N
Literature Reference Author M.RAMDANI,A.LOUPY,A.PETIT
Literature Reference Citation MOLECULES,4,M99(1999)
Literature Reference DOI 10.3390/m99
Molecular Weight 438.666 g/mol
Solvent CDCl3
Source File Reference UWVN7123