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3-iodanyl-4-(phenylmethyl)-2-propyl-2H-furan-5-one
SpectraBase Compound ID 40FjErmNOcz
InChI InChI=1S/C14H15IO2/c1-2-6-12-13(15)11(14(16)17-12)9-10-7-4-3-5-8-10/h3-5,7-8,12H,2,6,9H2,1H3
InChIKey FKZUNJFHLXBSLU-UHFFFAOYSA-N
Mol Weight 342.18 g/mol
Molecular Formula C14H15IO2
Exact Mass 342.011675 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HDD5y8hftCf
Name 3-iodanyl-4-(phenylmethyl)-2-propyl-2H-furan-5-one
Alternate Name(s) 3-iodo-4-(phenylmethyl)-2-propyl-2H-furan-5-one 4-benzyl-3-iodo-2-propyl-2H-furan-5-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H15IO2
InChI InChI=1S/C14H15IO2/c1-2-6-12-13(15)11(14(16)17-12)9-10-7-4-3-5-8-10/h3-5,7-8,12H,2,6,9H2,1H3
InChIKey FKZUNJFHLXBSLU-UHFFFAOYSA-N
Molecular Weight 342.176 g/mol
SMILES C1(OC(C(=C1Cc1ccccc1)I)CCC)=O
SPLASH splash10-004i-0901000000-377b0a6077dbda9685c9
Source of Spectrum H-2005-3944-4
Wiley ID 1563207