| SpectraBase Compound ID | 5GUT3UXiAKI |
|---|---|
| InChI | InChI=1S/C16H17BrN2/c1-18-9-7-13-12-6-5-11(17)10-15(12)19-8-3-2-4-14(18)16(13)19/h3,5-6,8,10,14H,2,4,7,9H2,1H3/t14-/m0/s1 |
| InChIKey | IGXMRBGOOHQACP-AWEZNQCLSA-N |
| Mol Weight | 317.23 g/mol |
| Molecular Formula | C16H17BrN2 |
| Exact Mass | 316.057512 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HlO2kNxxhy4 |
|---|---|
| Name | Arborescidine B |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H17BrN2 |
| InChI | InChI=1S/C16H17BrN2/c1-18-9-7-13-12-6-5-11(17)10-15(12)19-8-3-2-4-14(18)16(13)19/h3,5-6,8,10,14H,2,4,7,9H2,1H3/t14-/m0/s1 |
| InChIKey | IGXMRBGOOHQACP-AWEZNQCLSA-N |
| Molecular Weight | 317.230 g/mol |
| SMILES | c12[n]3C=CCC[C@@]1(N(CCc2c1c3cc(cc1)Br)C)[H] |
| SPLASH | splash10-014i-0059000000-88893204b1745f100f31 |
| Source of Spectrum | X2-56-104-2 |
| Wiley ID | 1604684 |