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Diethyl (trans)-[3'-iodo-1-methylheptyl]phosphonate
SpectraBase Compound ID 1jQ2LJRPgFt
InChI InChI=1S/C12H26IO3P/c1-5-8-9-12(13)10-11(4)17(14,15-6-2)16-7-3/h11-12H,5-10H2,1-4H3
InChIKey FPKMAPXKFJXCEV-UHFFFAOYSA-N
Mol Weight 376.22 g/mol
Molecular Formula C12H26IO3P
Exact Mass 376.066427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J4jQ4uIIbeu
Name Diethyl (trans)-[3'-iodo-1-methylheptyl]phosphonate
Alternate Name(s) Diethyl (cis)-[3'-iodo-1-methylheptyl]phosphonate Diethyl 3-iodo-1-methylheptylphosphonate Diethyl cis-3-iodo-1-methylheptylphosphonate Diethyl trans-3-iodo-1-methylheptylphosphonate
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Formula C12H26IO3P
InChI InChI=1S/C12H26IO3P/c1-5-8-9-12(13)10-11(4)17(14,15-6-2)16-7-3/h11-12H,5-10H2,1-4H3
InChIKey FPKMAPXKFJXCEV-UHFFFAOYSA-N
Molecular Weight 376.215 g/mol
SMILES C(P(=O)(OCC)OCC)(CC(I)CCCC)C
SPLASH splash10-0002-4190000000-5bf32335e85303058d75
Source of Spectrum C3-25-663-3
Wiley ID 879827