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4-(2-thenoyl)pimelic acid dimethyl ester
SpectraBase Compound ID BWl0XK26IC8
InChI InChI=1S/C14H18O5S/c1-18-12(15)7-5-10(6-8-13(16)19-2)14(17)11-4-3-9-20-11/h3-4,9-10H,5-8H2,1-2H3
InChIKey UMGHXDRLJUJOMG-UHFFFAOYSA-N
Mol Weight 298.35 g/mol
Molecular Formula C14H18O5S
Exact Mass 298.087495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzZIl6Ng3Aq
Name 4-(2-thenoyl)pimelic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O5S
InChI InChI=1S/C14H18O5S/c1-18-12(15)7-5-10(6-8-13(16)19-2)14(17)11-4-3-9-20-11/h3-4,9-10H,5-8H2,1-2H3
InChIKey UMGHXDRLJUJOMG-UHFFFAOYSA-N
Molecular Weight 298.353 g/mol
SMILES C(CCC(CCC(=O)OC)C(=O)c1cccs1)(=O)OC
SPLASH splash10-03di-0960000000-bdfe5ccdf8221c0a7330
Source of Spectrum C5-2005-238-10
Synonyms 4-[oxo(thiophen-2-yl)methyl]heptanedioic acid dimethyl ester Dimethyl 4-(thiophene-2-carbonyl)heptanedioate Dimethyl 4-thiophen-2-ylcarbonylheptanedioate
Wiley ID 1617955