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4-Imino-2-(methylsulfanyl)-3-(phenylsulfonyl)-4H-quinolizine-1-carbonitrile
SpectraBase Compound ID 64UJXtJha2f
InChI InChI=1S/C17H13N3O2S2/c1-23-15-13(11-18)14-9-5-6-10-20(14)17(19)16(15)24(21,22)12-7-3-2-4-8-12/h2-10,19H,1H3
InChIKey YOCRYPKQGMTUGV-UHFFFAOYSA-N
Mol Weight 355.43 g/mol
Molecular Formula C17H13N3O2S2
Exact Mass 355.044919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CEUUuucC0
Name 4-Imino-2-(methylsulfanyl)-3-(phenylsulfonyl)-4H-quinolizine-1-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13N3O2S2
InChI InChI=1S/C17H13N3O2S2/c1-23-15-13(11-18)14-9-5-6-10-20(14)17(19)16(15)24(21,22)12-7-3-2-4-8-12/h2-10,19H,1H3
InChIKey YOCRYPKQGMTUGV-UHFFFAOYSA-N
Molecular Weight 355.430 g/mol
SMILES N=C1C(S(=O)(=O)c2ccccc2)=C(C(=C2C=CC=CN12)C#N)SC
SPLASH splash10-00kf-0392000000-164de5f35b19df51db35
Source of Spectrum U1-2009-5851-3a
Synonyms 3-(benzenesulfonyl)-4-imino-2-(methylthio)-1-quinolizinecarbonitrile 3-(benzenesulfonyl)-4-imino-2-methylsulfanylquinolizine-1-carbonitrile 3-(benzenesulfonyl)-4-imino-2-methylsulfanyl-quinolizine-1-carbonitrile 4-Azanylidene-2-methylsulfanyl-3-(phenylsulfonyl)quinolizine-1-carbonitrile
Wiley ID 1697377