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2-Ethyl-6-(2-p-toluolsulfonylhydrazino)-3,4,5-trihydroazocino[2,4-cd]thionaphthene
SpectraBase Compound ID DjUxz5fBRol
InChI InChI=1S/C21H23N3O2S2/c1-3-18-16-6-4-9-20(22-17-7-5-8-19(27-18)21(16)17)23-24-28(25,26)15-12-10-14(2)11-13-15/h5,7-8,10-13,24H,3-4,6,9H2,1-2H3,(H,22,23)
InChIKey RXGQKZHKRSQRCZ-UHFFFAOYSA-N
Mol Weight 413.55 g/mol
Molecular Formula C21H23N3O2S2
Exact Mass 413.123169 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GzPMzuEa0
Name 2-Ethyl-6-(2-p-toluolsulfonylhydrazino)-3,4,5-trihydroazocino[2,4-cd]thionaphthene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3O2S2
InChI InChI=1S/C21H23N3O2S2/c1-3-18-16-6-4-9-20(22-17-7-5-8-19(27-18)21(16)17)23-24-28(25,26)15-12-10-14(2)11-13-15/h5,7-8,10-13,24H,3-4,6,9H2,1-2H3,(H,22,23)
InChIKey RXGQKZHKRSQRCZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.19793120506
Molecular Weight 413.554 g/mol
SMILES N1C(=NNS(c2ccc(cc2)C)(=O)=O)CCCc2c3c(cccc13)sc2CC
SPLASH splash10-0kbf-4390000000-e21fa839284cf39b52dc
Source of Spectrum APC-312-403-9a
Synonyms N'-(1-ethyl-9,10-dihydro-6H-2-thia-6-azacycloocta[cd]inden-7(8H)-ylidene)-4-methylbenzenesulfonohydrazide
Wiley ID 1787813