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4-[(E)-1-Phenylmethylidene]-3,4-dihydro-2H-benzo[b]thiine-2-carbonitrile
SpectraBase Compound ID DEwu9FYbNby
InChI InChI=1S/C17H13NS/c18-12-15-11-14(10-13-6-2-1-3-7-13)16-8-4-5-9-17(16)19-15/h1-10,15H,11H2/b14-10+
InChIKey MRMZZPLHFCIWJO-GXDHUFHOSA-N
Mol Weight 263.36 g/mol
Molecular Formula C17H13NS
Exact Mass 263.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XuiJtpnvaS
Name 4-[(E)-1-Phenylmethylidene]-3,4-dihydro-2H-benzo[b]thiine-2-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13NS
InChI InChI=1S/C17H13NS/c18-12-15-11-14(10-13-6-2-1-3-7-13)16-8-4-5-9-17(16)19-15/h1-10,15H,11H2/b14-10+
InChIKey MRMZZPLHFCIWJO-GXDHUFHOSA-N
Molecular Weight 263.358 g/mol
SMILES c12\C(CC(Sc2cccc1)C#N)=C\c1ccccc1
SPLASH splash10-03di-1090000000-b56b317c33d905e17d0d
Source of Spectrum QA-48-340-27
Synonyms (4E)-4-benzylidene-3,4-dihydro-2H-1-benzothiopyran-2-carbonitrile
Wiley ID 863474