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Methyl (2R,3R,4S)-[4-(Benzenesulfinyl)-5-oxo-2-propyltetrahydrofuran-3-yl]acetate
SpectraBase Compound ID 2LQBXfiyrp1
InChI InChI=1S/C16H20O5S/c1-3-7-13-12(10-14(17)20-2)15(16(18)21-13)22(19)11-8-5-4-6-9-11/h4-6,8-9,12-13,15H,3,7,10H2,1-2H3/t12-,13-,15+,22?/m1/s1
InChIKey ZHEWASORYXZGFV-PIGRXPBASA-N
Mol Weight 324.39 g/mol
Molecular Formula C16H20O5S
Exact Mass 324.103145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lg6wzeYjZGv
Name Methyl (2R,3R,4S)-[4-(Benzenesulfinyl)-5-oxo-2-propyltetrahydrofuran-3-yl]acetate
Alternate Name(s) Methyl[(2R,3R,4S)-5-oxo-4-(phenylsulfinyl)-2-propyltetrahydro-3-furanyl]acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O5S
InChI InChI=1S/C16H20O5S/c1-3-7-13-12(10-14(17)20-2)15(16(18)21-13)22(19)11-8-5-4-6-9-11/h4-6,8-9,12-13,15H,3,7,10H2,1-2H3/t12-,13-,15+,22?/m1/s1
InChIKey ZHEWASORYXZGFV-PIGRXPBASA-N
Molecular Weight 324.391 g/mol
SMILES [C@@]1(C(O[C@@]([C@]1(CC(=O)OC)[H])(CCC)[H])=O)(S(=O)c1ccccc1)[H]
SPLASH splash10-002b-0900000000-257100b0a6b0cc4db81d
Source of Spectrum J-59-4471-42
Wiley ID 1323016