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2-[(4S,5R,6S)-2,2,5-trimethyl-6-(phenylsulfonylmethyl)-1,3-dioxan-4-yl]ethyl ethanoate
SpectraBase Compound ID 19KYYwQalx9
InChI InChI=1S/C18H26O6S/c1-13-16(10-11-22-14(2)19)23-18(3,4)24-17(13)12-25(20,21)15-8-6-5-7-9-15/h5-9,13,16-17H,10-12H2,1-4H3/t13-,16+,17-/m1/s1
InChIKey VKNNZNYWAZAKSY-XOKHGSTOSA-N
Mol Weight 370.46 g/mol
Molecular Formula C18H26O6S
Exact Mass 370.14501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ctemw5PuK
Name 2-[(4S,5R,6S)-2,2,5-trimethyl-6-(phenylsulfonylmethyl)-1,3-dioxan-4-yl]ethyl ethanoate
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Formula C18H26O6S
InChI InChI=1S/C18H26O6S/c1-13-16(10-11-22-14(2)19)23-18(3,4)24-17(13)12-25(20,21)15-8-6-5-7-9-15/h5-9,13,16-17H,10-12H2,1-4H3/t13-,16+,17-/m1/s1
InChIKey VKNNZNYWAZAKSY-XOKHGSTOSA-N
Molecular Weight 370.460 g/mol
SMILES C(S(=O)(=O)c1ccccc1)[C@]1(OC(C)(C)O[C@]([C@]1(C)[H])(CCOC(=O)C)[H])[H]
SPLASH splash10-00kf-6092000000-9b92c8814b938533dfab
Source of Spectrum F-53-9787-3
Synonyms 2-[(4S,5R,6S)-6-(benzenesulfonylmethyl)-2,2,5-trimethyl-1,3-dioxan-4-yl]ethyl acetate Acetic acid 2-[(4S,5R,6S)-6-(benzenesulfonylmethyl)-2,2,5-trimethyl-1,3-dioxan-4-yl]ethyl ester Acetic acid 2-[(4S,5R,6S)-6-(besylmethyl)-2,2,5-trimethyl-1,3-dioxan-4-yl]ethyl ester
Wiley ID 803038