![1-ethyl-2-{[(3,5-xylyl)oxy]methyl]indole-3-methanol, m-chlorobenzoate(ester)](/api/spectrum/D77NGPBIQjq/structure.png?h=300&w=458 "1-ethyl-2-{[(3,5-xylyl)oxy]methyl]indole-3-methanol, m-chlorobenzoate(ester)")
| SpectraBase Compound ID | AiibqV8nqM5 |
|---|---|
| InChI | InChI=1S/C27H26ClNO3/c1-4-29-25-11-6-5-10-23(25)24(16-32-27(30)20-8-7-9-21(28)15-20)26(29)17-31-22-13-18(2)12-19(3)14-22/h5-15H,4,16-17H2,1-3H3 |
| InChIKey | DNEZIJXWVBAHHZ-UHFFFAOYSA-N |
| Mol Weight | 447.96 g/mol |
| Molecular Formula | C27H26ClNO3 |
| Exact Mass | 447.160121 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D77NGPBIQjq |
|---|---|
| Name | 1-ethyl-2-{[(3,5-xylyl)oxy]methyl]indole-3-methanol, m-chlorobenzoate(ester) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H26ClNO3 |
| InChI | InChI=1S/C27H26ClNO3/c1-4-29-25-11-6-5-10-23(25)24(16-32-27(30)20-8-7-9-21(28)15-20)26(29)17-31-22-13-18(2)12-19(3)14-22/h5-15H,4,16-17H2,1-3H3 |
| InChIKey | DNEZIJXWVBAHHZ-UHFFFAOYSA-N |
| Instrument Name | Varian A-60D |
| Sadtler NMR Number | 20474M |
| Solvent | CDCl3 |