| SpectraBase Compound ID | 7C6khXGuoZF |
|---|---|
| InChI | InChI=1S/C18H24BrN/c19-14-11-12-18-16(13-14)15-9-7-5-3-1-2-4-6-8-10-17(15)20-18/h11-13,20H,1-10H2 |
| InChIKey | YRIAOMMQOIJSAY-UHFFFAOYSA-N |
| Mol Weight | 334.3 g/mol |
| Molecular Formula | C18H24BrN |
| Exact Mass | 333.109213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C7e3Sppuk4j |
|---|---|
| Name | 5-Bromo-2,3-cyclododecenoindole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.109212777 u |
| Formula | C18H24BrN |
| InChI | InChI=1S/C18H24BrN/c19-14-11-12-18-16(13-14)15-9-7-5-3-1-2-4-6-8-10-17(15)20-18/h11-13,20H,1-10H2 |
| InChIKey | YRIAOMMQOIJSAY-UHFFFAOYSA-N |
| Molecular Weight | 334.301 g/mol |
| SMILES | C1CCCCCCCCC2=C(C1)C1=CC(=CC=C1N2)Br |