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Ethyl (S)-6-hydroxy-6-[(2'S,5'R)-5'-(1''-hydroxy-1''-methylethyl)-2'-methyl-tetrahydrofuran-2'-yl]-3-methylhex-2-enoate
SpectraBase Compound ID LimL5SEDI5m
InChI InChI=1S/C17H30O5/c1-6-21-15(19)11-12(2)7-8-13(18)17(5)10-9-14(22-17)16(3,4)20/h11,13-14,18,20H,6-10H2,1-5H3/b12-11+/t13-,14+,17-/m0/s1
InChIKey ROXXHFOUQCWXCV-SRDVYTNVSA-N
Mol Weight 314.42 g/mol
Molecular Formula C17H30O5
Exact Mass 314.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Gi0tYhqRm0
Name Ethyl (S)-6-hydroxy-6-[(2'S,5'R)-5'-(1''-hydroxy-1''-methylethyl)-2'-methyl-tetrahydrofuran-2'-yl]-3-methylhex-2-enoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.209324061 u
Formula C17H30O5
InChI InChI=1S/C17H30O5/c1-6-21-15(19)11-12(2)7-8-13(18)17(5)10-9-14(22-17)16(3,4)20/h11,13-14,18,20H,6-10H2,1-5H3/b12-11+/t13-,14+,17-/m0/s1
InChIKey ROXXHFOUQCWXCV-SRDVYTNVSA-N
SMILES [C@]1(O[C@](CC1)(C(O)(C)C)[H])([C@](CC\C(=C\C(=O)OCC)C)(O)[H])C