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1-(1-besylpyrrol-3-yl)-4,4-dimethoxy-butan-1-one
SpectraBase Compound ID KuKUqndvBzc
InChI InChI=1S/C16H19NO5S/c1-21-16(22-2)9-8-15(18)13-10-11-17(12-13)23(19,20)14-6-4-3-5-7-14/h3-7,10-12,16H,8-9H2,1-2H3
InChIKey DWCCILWJKYPJQT-UHFFFAOYSA-N
Mol Weight 337.39 g/mol
Molecular Formula C16H19NO5S
Exact Mass 337.098394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57cSpNpbExB
Name 1-(1-besylpyrrol-3-yl)-4,4-dimethoxy-butan-1-one
Alternate Name(s) 1-[1-(benzenesulfonyl)-3-pyrrolyl]-4,4-dimethoxy-1-butanone 1-[1-(benzenesulfonyl)pyrrol-3-yl]-4,4-dimethoxy-butan-1-one 4,4-Dimethoxy-1-[1-(phenylsulfonyl)pyrrol-3-yl]butan-1-one
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Formula C16H19NO5S
InChI InChI=1S/C16H19NO5S/c1-21-16(22-2)9-8-15(18)13-10-11-17(12-13)23(19,20)14-6-4-3-5-7-14/h3-7,10-12,16H,8-9H2,1-2H3
InChIKey DWCCILWJKYPJQT-UHFFFAOYSA-N
Molecular Weight 337.390 g/mol
SMILES c1[n](ccc1C(CCC(OC)OC)=O)S(=O)(=O)c1ccccc1
SPLASH splash10-004i-9010000000-bd5943ab0b55c474cb10
Source of Spectrum E1-43-42-14
Wiley ID 1552882