6,7,8,9,10,11,12,13,14,15,21,22-Dodecahydro-5H-dibenzo-[E,R]--[1,4,8,12,16]-dithia-triaza-cyclononadecine-water(1:1)
Compound with spectra: 2 NMR
![6,7,8,9,10,11,12,13,14,15,21,22-Dodecahydro-5H-dibenzo-[E,R]--[1,4,8,12,16]-dithia-triaza-cyclononadecine-water(1:1)](/api/compound/BrQjqxhqqqN.png?ph=true&h=300&w=458 "6,7,8,9,10,11,12,13,14,15,21,22-Dodecahydro-5H-dibenzo-[E,R]--[1,4,8,12,16]-dithia-triaza-cyclononadecine-water(1:1)")
| SpectraBase Compound ID | BrQjqxhqqqN |
|---|---|
| InChI | InChI=1S/C22H31N3S2/c1-3-9-21-19(7-1)17-24-13-5-11-23-12-6-14-25-18-20-8-2-4-10-22(20)27-16-15-26-21/h1-4,7-10,23-25H,5-6,11-18H2 |
| InChIKey | BTPWDZAXQKRXIJ-UHFFFAOYSA-N |
| Mol Weight | 401.63 g/mol |
| Molecular Formula | C22H31N3S2 |
| Exact Mass | 401.19594 g/mol |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
6,7,8,9,10,11,12,13,19,20-Decahydro-5H-dibenzo-[E,P]-[1,4,8,11,14]-dithia-triaza-cycloheptadecine-water(1:1)
6,7,8,9,15,16,17,18-Octahydro-5,14-dithia-8,17-diaza-dibenzo[a]cyclotetradecene
N-benzyl-1-(2-(prop-2-yn-1-ylthio)phenyl)methanamine
2-(5-Ketopentylthio)benzamide
2-(BUT-3'-ENYLTHIO)-BENZAMIDE
5,6,7,8,9,10,11,12,13,14,15,20,21,22,23,24-HEXADECAHYDRODIBENZO-[B,O]-[1,5,9,13,17]-PENTAAZACYCLOEICOSINE
1,5,9-Benzotriazacyclododecine, 1,2,3,4,5,6,7,8,9,10-decahydro-
Tert-Butyle 2-{[2-(hydroxymethyl)phenyl]sulfanyl}acetate
JLCUDHRXCZPFMP-UHFFFAOYSA-N
THIOCHROMAN-3-ON
| Title | Journal or Book | Year |
|---|---|---|
| New Macrocyclic Ligands. Synthesis of an Extensive Series of Potentially Pentadentate Ligands Containing Mixed Nitrogen, Oxygen and or Sulfur Heteroatoms. The X-Ray Structure of an O2N2S Derivative | Australian Journal of Chemistry | 1987 |