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1-(benzenesulfonyl)-4-benzyloxy-6-(1,3-dioxan-2-yl)indole
SpectraBase Compound ID EskTus8McqH
InChI InChI=1S/C25H23NO5S/c27-32(28,21-10-5-2-6-11-21)26-13-12-22-23(26)16-20(25-29-14-7-15-30-25)17-24(22)31-18-19-8-3-1-4-9-19/h1-6,8-13,16-17,25H,7,14-15,18H2
InChIKey WQSDUKDOWDBXFS-UHFFFAOYSA-N
Mol Weight 449.52 g/mol
Molecular Formula C25H23NO5S
Exact Mass 449.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L6YayhXOatf
Name 1-(benzenesulfonyl)-4-benzyloxy-6-(1,3-dioxan-2-yl)indole
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Formula C25H23NO5S
InChI InChI=1S/C25H23NO5S/c27-32(28,21-10-5-2-6-11-21)26-13-12-22-23(26)16-20(25-29-14-7-15-30-25)17-24(22)31-18-19-8-3-1-4-9-19/h1-6,8-13,16-17,25H,7,14-15,18H2
InChIKey WQSDUKDOWDBXFS-UHFFFAOYSA-N
Molecular Weight 449.521 g/mol
SMILES c12[n](S(=O)(=O)c3ccccc3)ccc1c(OCc1ccccc1)cc(c2)C1OCCCO1
SPLASH splash10-0006-9001100000-92317d272c85dcea81b3
Source of Spectrum E1-43-44-20
Synonyms 1-(benzenesulfonyl)-6-(1,3-dioxan-2-yl)-4-phenylmethoxyindole 4-Benzoxy-1-besyl-6-(1,3-dioxan-2-yl)indole 6-(1,3-dioxan-2-yl)-4-phenylmethoxy-1-(phenylsulfonyl)indole
Wiley ID 1552853