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4-(5-acetyl-2-thienyl)-3-iodo-butan-2-one
SpectraBase Compound ID 9e8aDipmsAz
InChI InChI=1S/C10H11IO2S/c1-6(12)9(11)5-8-3-4-10(14-8)7(2)13/h3-4,9H,5H2,1-2H3
InChIKey ZLVBXFJESBXAAK-UHFFFAOYSA-N
Mol Weight 322.16 g/mol
Molecular Formula C10H11IO2S
Exact Mass 321.952446 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 97Gre2W5tBl
Name 4-(5-acetyl-2-thienyl)-3-iodo-butan-2-one
Alternate Name(s) 4-(5-acetyl-2-thiophenyl)-3-iodo-2-butanone 4-(5-acetylthiophen-2-yl)-3-iodobutan-2-one 4-(5-Ethanoylthiophen-2-yl)-3-iodanyl-butan-2-one
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Formula C10H11IO2S
InChI InChI=1S/C10H11IO2S/c1-6(12)9(11)5-8-3-4-10(14-8)7(2)13/h3-4,9H,5H2,1-2H3
InChIKey ZLVBXFJESBXAAK-UHFFFAOYSA-N
Molecular Weight 322.160 g/mol
SMILES c1(sc(cc1)CC(C(=O)C)I)C(=O)C
SPLASH splash10-0002-0900000000-58627fad09d7ca409cfc
Source of Spectrum K1-2000-1657-3
Wiley ID 750119