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(E)-2-hexenethioic acid S-(2-naphthalenyl) ester
SpectraBase Compound ID Gy7sxC1E41s
InChI InChI=1S/C16H16OS/c1-2-3-4-9-16(17)18-15-11-10-13-7-5-6-8-14(13)12-15/h4-12H,2-3H2,1H3/b9-4+
InChIKey WBNMZJSHNVHGQU-RUDMXATFSA-N
Mol Weight 256.36 g/mol
Molecular Formula C16H16OS
Exact Mass 256.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H9qK37nqYIA
Name (E)-2-hexenethioic acid S-(2-naphthalenyl) ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16OS
InChI InChI=1S/C16H16OS/c1-2-3-4-9-16(17)18-15-11-10-13-7-5-6-8-14(13)12-15/h4-12H,2-3H2,1H3/b9-4+
InChIKey WBNMZJSHNVHGQU-RUDMXATFSA-N
Molecular Weight 256.363 g/mol
SMILES C(Sc1cc2ccccc2cc1)(\C=C\CCC)=O
SPLASH splash10-0a4j-9100000000-f4dc0dbc5343c54eb0c6
Source of Spectrum J-59-2611-9
Synonyms (E)-hex-2-enethioic acid S-(2-naphthyl) ester S-(2-naphthyl) (E)-hex-2-enethioate S-naphthalen-2-yl (E)-hex-2-enethioate
Wiley ID 1260020