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Isopropylidene trans-3-hydroxy-2-methoxy-5-phenylthiotetrahydropyran-4,4-dicarboxylate
SpectraBase Compound ID Aa2REPEzV9w
InChI InChI=1S/C17H20O7S/c1-16(2)23-14(19)17(15(20)24-16)11(9-22-13(21-3)12(17)18)25-10-7-5-4-6-8-10/h4-8,11-13,18H,9H2,1-3H3/t11-,12+,13-/m1/s1
InChIKey ZOTGQFWTJRHIOZ-FRRDWIJNSA-N
Mol Weight 368.4 g/mol
Molecular Formula C17H20O7S
Exact Mass 368.092974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZsZsuRxaEB
Name Isopropylidene trans-3-hydroxy-2-methoxy-5-phenylthiotetrahydropyran-4,4-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O7S
InChI InChI=1S/C17H20O7S/c1-16(2)23-14(19)17(15(20)24-16)11(9-22-13(21-3)12(17)18)25-10-7-5-4-6-8-10/h4-8,11-13,18H,9H2,1-3H3/t11-,12+,13-/m1/s1
InChIKey ZOTGQFWTJRHIOZ-FRRDWIJNSA-N
Molecular Weight 368.400 g/mol
SMILES O[C@@]1(C2(C(OC(OC2=O)(C)C)=O)[C@](Sc2ccccc2)(CO[C@]1(OC)[H])[H])[H]
SPLASH splash10-074m-8900000000-c9d613c000d95fb83ac8
Source of Spectrum AT-38-8004-7
Synonyms (7R,8R,11S)-7-hydroxy-8-methoxy-3,3-dimethyl-11-(phenylsulfanyl)-2,4,9-trioxaspiro[5.5]undecane-1,5-dione Isopropylidene trans-2-hydroxy-3-methoxy-6-phenylthiotetrahydropyran-1,1-dicarboxylate
Wiley ID 853986