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(Z)-Ethyl 3-carboethoxy-6-phenylthio-2-hexenoate
SpectraBase Compound ID 2ZnjEdCQD24
InChI InChI=1S/C17H22O4S/c1-3-20-16(18)13-14(17(19)21-4-2)9-8-12-22-15-10-6-5-7-11-15/h5-7,10-11,13H,3-4,8-9,12H2,1-2H3/b14-13-
InChIKey PERVMGMUUFDZCT-YPKPFQOOSA-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 3mvrGYy9wwo
Name (Z)-Ethyl 3-carboethoxy-6-phenylthio-2-hexenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O4S
InChI InChI=1S/C17H22O4S/c1-3-20-16(18)13-14(17(19)21-4-2)9-8-12-22-15-10-6-5-7-11-15/h5-7,10-11,13H,3-4,8-9,12H2,1-2H3/b14-13-
InChIKey PERVMGMUUFDZCT-YPKPFQOOSA-N
Molecular Weight 322.419 g/mol
SMILES C(\C=C/(C(=O)OCC)CCCSc1ccccc1)(=O)OCC
SPLASH splash10-01vp-1900000000-469b5665c4a12badc0f0
Source of Spectrum F-48-2039-24
Synonyms Diethyl (2Z)-2-[3-(phenylsulfanyl)propyl]-2-butenedioate
Wiley ID 1321587