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4-(1-Iodooctyl)dihydro-2(3H)-furanone
SpectraBase Compound ID DGbXeBqS0YX
InChI InChI=1S/C12H21IO2/c1-2-3-4-5-6-7-11(13)10-8-12(14)15-9-10/h10-11H,2-9H2,1H3
InChIKey SIPDZSZUDQINSJ-UHFFFAOYSA-N
Mol Weight 324.2 g/mol
Molecular Formula C12H21IO2
Exact Mass 324.058625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BzfnMI5UMOZ
Name 4-(1-Iodooctyl)dihydro-2(3H)-furanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21IO2
InChI InChI=1S/C12H21IO2/c1-2-3-4-5-6-7-11(13)10-8-12(14)15-9-10/h10-11H,2-9H2,1H3
InChIKey SIPDZSZUDQINSJ-UHFFFAOYSA-N
Instrument Name Finnigan 4000 (GC mode) or Kratos MS-50
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0005.909
Molecular Weight 324.202 g/mol
SMILES CCCCCCCC(C1CC(OC1)=O)I
SPLASH splash10-000l-9400000000-d809caea0d31da40f83d
Sample Comments Isomer 1
Source of Spectrum ARK-2004-64-2g
Wiley ID 1876063