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(2S,6S)-1,7-bis(phenylmethoxy)-4-(phenylsulfonyl)heptane-2,6-diol
SpectraBase Compound ID IrmexClUn22
InChI InChI=1S/C27H32O6S/c28-24(20-32-18-22-10-4-1-5-11-22)16-27(34(30,31)26-14-8-3-9-15-26)17-25(29)21-33-19-23-12-6-2-7-13-23/h1-15,24-25,27-29H,16-21H2/t24-,25-/m0/s1
InChIKey FPTUYKSETKPMSM-DQEYMECFSA-N
Mol Weight 484.6 g/mol
Molecular Formula C27H32O6S
Exact Mass 484.19196 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1gR9uGl9pX9
Name (2S,6S)-1,7-bis(phenylmethoxy)-4-(phenylsulfonyl)heptane-2,6-diol
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Formula C27H32O6S
InChI InChI=1S/C27H32O6S/c28-24(20-32-18-22-10-4-1-5-11-22)16-27(34(30,31)26-14-8-3-9-15-26)17-25(29)21-33-19-23-12-6-2-7-13-23/h1-15,24-25,27-29H,16-21H2/t24-,25-/m0/s1
InChIKey FPTUYKSETKPMSM-DQEYMECFSA-N
Molecular Weight 484.607 g/mol
SMILES O[C@@](CC(C[C@](O)(COCc1ccccc1)[H])S(=O)(=O)c1ccccc1)(COCc1ccccc1)[H]
SPLASH splash10-000f-9240000000-fc69814319c001ec9491
Source of Spectrum K-2001-2620-73
Synonyms (2S,6S)-1,7-dibenzoxy-4-besyl-heptane-2,6-diol (2S,6S)-4-(benzenesulfonyl)-1,7-bis(phenylmethoxy)heptane-2,6-diol (2S,6S)-4-(benzenesulfonyl)-1,7-dibenzyloxy-heptane-2,6-diol
Wiley ID 1579765