| SpectraBase Compound ID | 8jBcbJFkHPT |
|---|---|
| InChI | InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15?,17?,18?,19?/m0/s1 |
| InChIKey | BLGXFZZNTVWLAY-YEKSSXHTSA-N |
| Mol Weight | 354.45 g/mol |
| Molecular Formula | C21H26N2O3 |
| Exact Mass | 354.194343 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HvR3CRjjSGV |
|---|---|
| Name | Yohimbine - isomer |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H26N2O3 |
| InChI | InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15?,17?,18?,19?/m0/s1 |
| InChIKey | BLGXFZZNTVWLAY-YEKSSXHTSA-N |
| Molecular Weight | 354.450 g/mol |
| SMILES | [nH]1c2ccccc2c2c1C1CC3C(C(CC[C@]3(CN1CC2)[H])O)C(=O)OC |
| SPLASH | splash10-068c-1922000000-caaebd111a9e3c89924e |
| Source of Spectrum | X2-50-873-0 |
| Wiley ID | 1602421 |