![3-{[1'-(p-Methylphenyl)sulfonyl]-6'-(benzyloxy)hexyl}-1H-indazole](/api/spectrum/CaBilOhHW8W/structure.png?h=300&w=458 "3-{[1'-(p-Methylphenyl)sulfonyl]-6'-(benzyloxy)hexyl}-1H-indazole")
| SpectraBase Compound ID | GyMjjxFUFeT |
|---|---|
| InChI | InChI=1S/C27H30N2O3S/c1-21-15-17-23(18-16-21)33(30,31)26(27-24-12-7-8-13-25(24)28-29-27)14-6-3-9-19-32-20-22-10-4-2-5-11-22/h2,4-5,7-8,10-13,15-18,26H,3,6,9,14,19-20H2,1H3,(H,28,29) |
| InChIKey | SFUMKGJFEFFQIJ-UHFFFAOYSA-N |
| Mol Weight | 462.61 g/mol |
| Molecular Formula | C27H30N2O3S |
| Exact Mass | 462.197714 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CaBilOhHW8W |
|---|---|
| Name | 3-{[1'-(p-Methylphenyl)sulfonyl]-6'-(benzyloxy)hexyl}-1H-indazole |
| Alternate Name(s) | 3-[1-(4-methylphenyl)sulfonyl-6-phenylmethoxyhexyl]-2H-indazole 3-[6-benzyloxy-1-(p-tolylsulfonyl)hexyl]-2H-indazole 3-[1-(4-methylphenyl)sulfonyl-6-phenylmethoxy-hexyl]-2H-indazole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H30N2O3S |
| InChI | InChI=1S/C27H30N2O3S/c1-21-15-17-23(18-16-21)33(30,31)26(27-24-12-7-8-13-25(24)28-29-27)14-6-3-9-19-32-20-22-10-4-2-5-11-22/h2,4-5,7-8,10-13,15-18,26H,3,6,9,14,19-20H2,1H3,(H,28,29) |
| InChIKey | SFUMKGJFEFFQIJ-UHFFFAOYSA-N |
| Molecular Weight | 462.608 g/mol |
| SMILES | [nH]1c2c(c(n1)C(S(c1ccc(cc1)C)(=O)=O)CCCCCOCc1ccccc1)cccc2 |
| SPLASH | splash10-015c-6910000000-a41ab52aa624e5fb41c0 |
| Source of Spectrum | U1-2009-3187-6g |
| Wiley ID | 1696979 |