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Dimethyl 2-[rel-(2R,4R,6R)-4-phenyl-2-(thien-2-yl)-tetrahydropyr-6-yl]-methyl succinate
SpectraBase Compound ID 3ECck5Jv6s7
InChI InChI=1S/C22H26O5S/c1-25-21(23)14-17(22(24)26-2)12-18-11-16(15-7-4-3-5-8-15)13-19(27-18)20-9-6-10-28-20/h3-10,16-19H,11-14H2,1-2H3/t16-,17?,18-,19-/m1/s1
InChIKey KDSTWMZVQXHLMC-CEBOQPEMSA-N
Mol Weight 402.51 g/mol
Molecular Formula C22H26O5S
Exact Mass 402.150095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bEWXIo8UUl
Name Dimethyl 2-[rel-(2R,4R,6R)-4-phenyl-2-(thien-2-yl)-tetrahydropyr-6-yl]-methyl succinate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O5S
InChI InChI=1S/C22H26O5S/c1-25-21(23)14-17(22(24)26-2)12-18-11-16(15-7-4-3-5-8-15)13-19(27-18)20-9-6-10-28-20/h3-10,16-19H,11-14H2,1-2H3/t16-,17?,18-,19-/m1/s1
InChIKey KDSTWMZVQXHLMC-CEBOQPEMSA-N
Molecular Weight 402.505 g/mol
SMILES [C@@]1(O[C@](C[C@](C1)(c1ccccc1)[H])(CC(C(=O)OC)CC(=O)OC)[H])(c1sccc1)[H]
SPLASH splash10-0uxr-2960100000-67a475d2d8ab4f8db4b1
Source of Spectrum F-70-1346-14j
Synonyms Dimethyl 2-[rel-(2R,4R,6R)-4-phenyl-2-(thien-2-yl)-tetrahydropyran-6-yl]-methyl succinate Dimethyl 2-(((2R,4R,6R)-4-phenyl-6-(thiophen-2-yl)tetrahydro-2H-pyran-2-yl)methyl)succinate
Wiley ID 1742593