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Methyl (2RS,4RS)-2-ethoxy-3,4-dihydro-4-[2-(phenylthio)ethyl]-2H-pyran-5-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl (2RS,4RS)-2-ethoxy-3,4-dihydro-4-[2-(phenylthio)ethyl]-2H-pyran-5-carboxylate
SpectraBase Compound ID KRVUYrBblB8
InChI InChI=1S/C17H22O4S/c1-3-20-16-11-13(15(12-21-16)17(18)19-2)9-10-22-14-7-5-4-6-8-14/h4-8,12-13,16H,3,9-11H2,1-2H3
InChIKey AFLRFMRCXHKVOE-UHFFFAOYSA-N
Mol Weight 322.42 g/mol
Molecular Formula C17H22O4S
Exact Mass 322.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DFKVpfqfH68
Name Methyl (2RS,4RS)-2-ethoxy-3,4-dihydro-4-[2-(phenylthio)ethyl]-2H-pyran-5-carboxylate
Alternate Name(s) Methyl 2-ethoxy-4-[2-(phenylsulfanyl)ethyl]-3,4-dihydro-2H-pyran-5-carboxylate
CAS Registry Number 117960-89-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O4S
InChI InChI=1S/C17H22O4S/c1-3-20-16-11-13(15(12-21-16)17(18)19-2)9-10-22-14-7-5-4-6-8-14/h4-8,12-13,16H,3,9-11H2,1-2H3
InChIKey AFLRFMRCXHKVOE-UHFFFAOYSA-N
Molecular Weight 322.419 g/mol
SMILES C1(=COC(CC1CCSc1ccccc1)OCC)C(=O)OC
SPLASH splash10-01b9-0901000000-61b0244173b7b3307b29
Source of Spectrum K-122-647-25
Wiley ID 1321580