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3-Phenyl-6,7-dihydro-4H,11bH-pyrrolo[2',1':3,4]pyrazino-[2,1-b][1,3]thiazine-4-thione
SpectraBase Compound ID CdFJvbs7gCe
InChI InChI=1S/C16H14N2S2/c19-15-13(12-5-2-1-3-6-12)11-20-16-14-7-4-8-17(14)9-10-18(15)16/h1-8,11,16H,9-10H2
InChIKey MHHPFTQTLMFPAC-UHFFFAOYSA-N
Mol Weight 298.42 g/mol
Molecular Formula C16H14N2S2
Exact Mass 298.059841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LfOkkkJYPQo
Name 3-Phenyl-6,7-dihydro-4H,11bH-pyrrolo[2',1':3,4]pyrazino-[2,1-b][1,3]thiazine-4-thione
Appearance Pale-brown solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 298.059840807 u
Formula C16H14N2S2
InChI InChI=1S/C16H14N2S2/c19-15-13(12-5-2-1-3-6-12)11-20-16-14-7-4-8-17(14)9-10-18(15)16/h1-8,11,16H,9-10H2
InChIKey MHHPFTQTLMFPAC-UHFFFAOYSA-N
Instrument Name Finnigan MAT INCOS 50
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900142
Quality 170
SMILES C1(=CC=CC=C1)C=1C(N2C(SC1)C=1N(CC2)C=CC1)=S
SPLASH splash10-0ar1-0930000000-b88fa93e0161b47c24a5
Source of Spectrum K1-2019-4155-3i (DOI: 10.1002/ejoc.201900142)
Thin-Layer Chromatography 0.53 (CH2Cl2/hexane, 65:35)
Wiley ID 1894477