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2-Allyl-4-methylene-3,4-dihydro-2H-benzo[b]thiine- 2-carbonitrile
SpectraBase Compound ID C3aLsJQyx0U
InChI InChI=1S/C14H13NS/c1-3-8-14(10-15)9-11(2)12-6-4-5-7-13(12)16-14/h3-7H,1-2,8-9H2
InChIKey DROSDKQQJWXWHZ-UHFFFAOYSA-N
Mol Weight 227.32 g/mol
Molecular Formula C14H13NS
Exact Mass 227.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBPkFy7uo6C
Name 2-Allyl-4-methylene-3,4-dihydro-2H-benzo[b]thiine- 2-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NS
InChI InChI=1S/C14H13NS/c1-3-8-14(10-15)9-11(2)12-6-4-5-7-13(12)16-14/h3-7H,1-2,8-9H2
InChIKey DROSDKQQJWXWHZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200000043
Molecular Weight 227.325 g/mol
SMILES c12SC(CC(c2cccc1)=C)(CC=C)C#N
SPLASH splash10-000i-0930000000-2908e4288e1eceaae948
Source of Spectrum QA-47-340-28a
Synonyms 2-Allyl-4-methylenethiochromane-2-carbonitrile
Wiley ID 1795104