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3-[2,3-dihydro-4-(2-naphthyl)-1,5-benzothiazepin-2-yl]-1-ethylpyridinium iodide
SpectraBase Compound ID 2AUOCECdyhS
InChI InChI=1S/C26H23N2S.HI/c1-2-28-15-7-10-22(18-28)26-17-24(27-23-11-5-6-12-25(23)29-26)21-14-13-19-8-3-4-9-20(19)16-21;/h3-16,18,26H,2,17H2,1H3;1H/q+1;/p-1
InChIKey IBEXWJHKKCHMRC-UHFFFAOYSA-M
Mol Weight 522.44847 g/mol
Molecular Formula C26H23IN2S
Exact Mass 522.062665 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID J5UQQFFXxCY
Name 3-[2,3-DIHYDRO-4-(2-NAPHTHYL)-1,5-BENZOTHIAZEPIN-2-YL]-1-ETHYLPYRIDINIUM IODIDE
Source of Sample K. Hideg, University Medical School, Pecs, Hungary
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23IN2S
InChI InChI=1S/C26H23N2S.HI/c1-2-28-15-7-10-22(18-28)26-17-24(27-23-11-5-6-12-25(23)29-26)21-14-13-19-8-3-4-9-20(19)16-21;/h3-16,18,26H,2,17H2,1H3;1H/q+1;/p-1
InChIKey IBEXWJHKKCHMRC-UHFFFAOYSA-M
Melting Point 180-181C
Molecular Weight 522.443970
Synonyms PYRIDINIUM IODIDE, 3-/2,3-DIHYDRO- 4-/2-NAPHTHYL/-1,5-BENZOTHIAZEPIN- 2-YL/-1-ETHYL-,
Technique KBr WAFER