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3-[1-(benzenesulfonyl)-6-(3-hydroxypropoxy)-4-indolyl]-1-propyl-2-piperidinone
SpectraBase Compound ID HZq9kt67BOj
InChI InChI=1S/C25H30N2O5S/c1-2-12-26-13-6-10-22(25(26)29)23-17-19(32-16-7-15-28)18-24-21(23)11-14-27(24)33(30,31)20-8-4-3-5-9-20/h3-5,8-9,11,14,17-18,22,28H,2,6-7,10,12-13,15-16H2,1H3
InChIKey CSVTVFZACHVFQJ-UHFFFAOYSA-N
Mol Weight 470.58 g/mol
Molecular Formula C25H30N2O5S
Exact Mass 470.187543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESvpPDiQNrf
Name 3-[1-(benzenesulfonyl)-6-(3-hydroxypropoxy)-4-indolyl]-1-propyl-2-piperidinone
Alternate Name(s) 3-[1-(benzenesulfonyl)-6-(3-hydroxypropoxy)indol-4-yl]-1-propyl-piperidin-2-one 3-[1-besyl-6-(3-hydroxypropoxy)indol-4-yl]-1-propyl-2-piperidone 3-[6-(3-oxidanylpropoxy)-1-(phenylsulfonyl)indol-4-yl]-1-propyl-piperidin-2-one
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Formula C25H30N2O5S
InChI InChI=1S/C25H30N2O5S/c1-2-12-26-13-6-10-22(25(26)29)23-17-19(32-16-7-15-28)18-24-21(23)11-14-27(24)33(30,31)20-8-4-3-5-9-20/h3-5,8-9,11,14,17-18,22,28H,2,6-7,10,12-13,15-16H2,1H3
InChIKey CSVTVFZACHVFQJ-UHFFFAOYSA-N
Molecular Weight 470.584 g/mol
SMILES OCCCOc1cc(c2cc[n](c2c1)S(=O)(=O)c1ccccc1)C1C(N(CCC1)CCC)=O
SPLASH splash10-00fr-5421900000-df6d6277cbd723635f36
Source of Spectrum E1-40-2351-42
Wiley ID 1519744