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(E)-5-phenyl-2-pentenethioic acid S-(2-furanylmethyl) ester
SpectraBase Compound ID 90smYL5zDih
InChI InChI=1S/C16H16O2S/c17-16(19-13-15-10-6-12-18-15)11-5-4-9-14-7-2-1-3-8-14/h1-3,5-8,10-12H,4,9,13H2/b11-5+
InChIKey ITKOVDOMVJFRDW-VZUCSPMQSA-N
Mol Weight 272.36 g/mol
Molecular Formula C16H16O2S
Exact Mass 272.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID W68ihudmcA
Name (E)-5-phenyl-2-pentenethioic acid S-(2-furanylmethyl) ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O2S
InChI InChI=1S/C16H16O2S/c17-16(19-13-15-10-6-12-18-15)11-5-4-9-14-7-2-1-3-8-14/h1-3,5-8,10-12H,4,9,13H2/b11-5+
InChIKey ITKOVDOMVJFRDW-VZUCSPMQSA-N
Molecular Weight 272.362 g/mol
SMILES C(SCc1occc1)(\C=C\CCc1ccccc1)=O
SPLASH splash10-000x-8940000000-b8bf354bdb29e0ab9558
Source of Spectrum K-2001-2397-10
Synonyms (E)-5-phenylpent-2-enethioic acid S-(2-furfuryl) ester S-(2-furylmethyl) (E)-5-phenylpent-2-enethioate S-(furan-2-ylmethyl) (E)-5-phenylpent-2-enethioate
Wiley ID 1580536