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Heptanoic acid, 4-oxo-5-(phenylseleno)-, methyl ester
SpectraBase Compound ID 5BTgXdP1mk5
InChI InChI=1S/C14H18O3Se/c1-3-13(12(15)9-10-14(16)17-2)18-11-7-5-4-6-8-11/h4-8,13H,3,9-10H2,1-2H3
InChIKey LYSBJHWLGCNGDS-UHFFFAOYSA-N
Mol Weight 313.27 g/mol
Molecular Formula C14H18O3Se
Exact Mass 314.042116 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E4lzHPk5ggc
Name Heptanoic acid, 4-oxo-5-(phenylseleno)-, methyl ester
Alternate Name(s) Methyl 4-oxo-5-(phenylselanyl)heptanoate Methyl 4-oxo-5-phenylselenoheptanoate
CAS Registry Number 109574-17-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3Se
InChI InChI=1S/C14H18O3Se/c1-3-13(12(15)9-10-14(16)17-2)18-11-7-5-4-6-8-11/h4-8,13H,3,9-10H2,1-2H3
InChIKey LYSBJHWLGCNGDS-UHFFFAOYSA-N
Molecular Weight 313.267 g/mol
SMILES C([Se]c1ccccc1)(C(=O)CCC(=O)OC)CC
SPLASH splash10-0a4i-0901000000-5ce3c758fe84b9a1ebc9
Source of Spectrum KC-1986-2003-0
Wiley ID 1314723