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Diethyl 2-oxo-5-pentyl-3-[(phenylthio)methyl]-tetrahydrofuran-3,4-dicarboxylate
SpectraBase Compound ID CeuFGmAuMaq
InChI InChI=1S/C22H30O6S/c1-4-7-9-14-17-18(19(23)26-5-2)22(21(25)28-17,20(24)27-6-3)15-29-16-12-10-8-11-13-16/h8,10-13,17-18H,4-7,9,14-15H2,1-3H3
InChIKey DSRSPICBCSUWPS-UHFFFAOYSA-N
Mol Weight 422.54 g/mol
Molecular Formula C22H30O6S
Exact Mass 422.17631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmrnKCLBpJw
Name Diethyl 2-oxo-5-pentyl-3-[(phenylthio)methyl]-tetrahydrofuran-3,4-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O6S
InChI InChI=1S/C22H30O6S/c1-4-7-9-14-17-18(19(23)26-5-2)22(21(25)28-17,20(24)27-6-3)15-29-16-12-10-8-11-13-16/h8,10-13,17-18H,4-7,9,14-15H2,1-3H3
InChIKey DSRSPICBCSUWPS-UHFFFAOYSA-N
Molecular Weight 422.536 g/mol
SMILES C1(C(OC(C1C(=O)OCC)CCCCC)=O)(C(=O)OCC)CSc1ccccc1
SPLASH splash10-00dj-4960200000-dda1f1c4227befd2310d
Source of Spectrum H-85-3808-0
Synonyms Diethyl 2-oxo-5-pentyl-3-[(phenylsulfanyl)methyl]tetrahydro-3,4-furandicarboxylate
Wiley ID 1524915