| SpectraBase Compound ID | 1XkJdwPbv5T |
|---|---|
| InChI | InChI=1S/C17H23N5S/c1-2-3-4-5-6-9-12-22-13-16(23-17-18-20-21-19-17)14-10-7-8-11-15(14)22/h7-8,10-11,13H,2-6,9,12H2,1H3,(H,18,19,20,21) |
| InChIKey | WGULPIQNAUVMPD-UHFFFAOYSA-N |
| Mol Weight | 329.47 g/mol |
| Molecular Formula | C17H23N5S |
| Exact Mass | 329.167417 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DdfRiXTjfPh |
|---|---|
| Name | 3-((1H-Tetrazol-5-yl)thio)-1-octyl-1H-indole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H23N5S |
| InChI | InChI=1S/C17H23N5S/c1-2-3-4-5-6-9-12-22-13-16(23-17-18-20-21-19-17)14-10-7-8-11-15(14)22/h7-8,10-11,13H,2-6,9,12H2,1H3,(H,18,19,20,21) |
| InChIKey | WGULPIQNAUVMPD-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1039/c4ra05625f |
| Molecular Weight | 329.466 g/mol |
| SMILES | [nH]1nnnc1Sc1c[n](CCCCCCCC)c2ccccc12 |
| SPLASH | splash10-03di-6972000000-fca1ab196ae95f937859 |
| Source of Spectrum | RSA-4-34526-3h |
| Wiley ID | 1749687 |