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4-Isobutenyl-2-(1'-hydroxyisobutyl)-1-(phenylsulfonyl)-1H-pyrrole
SpectraBase Compound ID HBIV6u7evEl
InChI InChI=1S/C18H23NO3S/c1-13(2)10-15-11-17(18(20)14(3)4)19(12-15)23(21,22)16-8-6-5-7-9-16/h5-12,14,18,20H,1-4H3
InChIKey MYYZOIIRRKIKAS-UHFFFAOYSA-N
Mol Weight 333.45 g/mol
Molecular Formula C18H23NO3S
Exact Mass 333.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Npl366iQE6
Name 4-Isobutenyl-2-(1'-hydroxyisobutyl)-1-(phenylsulfonyl)-1H-pyrrole
Comments Less than 3 mono-isotopic peaks
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Formula C18H23NO3S
InChI InChI=1S/C18H23NO3S/c1-13(2)10-15-11-17(18(20)14(3)4)19(12-15)23(21,22)16-8-6-5-7-9-16/h5-12,14,18,20H,1-4H3
InChIKey MYYZOIIRRKIKAS-UHFFFAOYSA-N
Molecular Weight 333.446 g/mol
SMILES OC(c1[n](S(=O)(=O)c2ccccc2)cc(C=C(C)C)c1)C(C)C
SPLASH splash10-0006-0092000000-d280c622c823df975bf5
Source of Spectrum U1-2009-3566-10
Synonyms 1-[1-(benzenesulfonyl)-4-(2-methylprop-1-enyl)-2-pyrrolyl]-2-methyl-1-propanol 1-[1-(benzenesulfonyl)-4-(2-methylprop-1-enyl)pyrrol-2-yl]-2-methylpropan-1-ol 1-[1-(benzenesulfonyl)-4-(2-methylprop-1-enyl)pyrrol-2-yl]-2-methyl-propan-1-ol 2-methyl-1-[4-(2-methylprop-1-enyl)-1-(phenylsulfonyl)pyrrol-2-yl]propan-1-ol
Wiley ID 1696872