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9H-Dithieno[3,4-b:3',4'-e]azepine, acetonitrile derivative

View entire compound with spectra: 3 FTIR

9H-Dithieno[3,4-b:3',4'-e]azepine, acetonitrile derivative
SpectraBase Compound ID Lh6nX3yHBdT
InChI InChI=1S/C17H16N4S2/c1-20-4-6-21(7-5-20)17-15-10-22-8-13(15)12(2-3-18)14-9-23-11-16(14)19-17/h2,8-11H,4-7H2,1H3/b12-2-
InChIKey RVQVUMIXBGFJLZ-OIXVIMQBSA-N
Mol Weight 340.46 g/mol
Molecular Formula C17H16N4S2
Exact Mass 340.081639 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9GnTItQD3P5
Name 9H-Dithieno[3,4-b:3',4'-e]azepine, acetonitrile derivative
CAS Registry Number 82650-83-7
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H16N4S2
InChI InChI=1S/C17H16N4S2/c1-20-4-6-21(7-5-20)17-15-10-22-8-13(15)12(2-3-18)14-9-23-11-16(14)19-17/h2,8-11H,4-7H2,1H3/b12-2-
InChIKey RVQVUMIXBGFJLZ-OIXVIMQBSA-N
Instrument Name Bruker IFS 88 C
Synonyms Acetonitrile, [5-(4-methyl-1-piperazinyl)-9H-dithieno[3,4-b:3',4'-e]azepin-9-ylidene]-, (E)-
Technique KBr-Pellet