| SpectraBase Compound ID | IQdDR4B5EmE |
|---|---|
| InChI | InChI=1S/C27H29N3O2/c1-3-18-17-30-15-13-19(18)16-24(30)26(21-12-14-28-23-10-6-4-8-20(21)23)29-27(31)22-9-5-7-11-25(22)32-2/h3-12,14,18-19,24,26H,1,13,15-17H2,2H3,(H,29,31)/t18?,19-,24?,26+/m1/s1 |
| InChIKey | YVXDJFTVKSVNNS-RDWVHJTESA-N |
| Mol Weight | 427.55 g/mol |
| Molecular Formula | C27H29N3O2 |
| Exact Mass | 427.225977 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 10arxQr7fU |
|---|---|
| Name | N-(9-Deoxycinchonin-9-yl)-2-methoxybenzamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H29N3O2 |
| InChI | InChI=1S/C27H29N3O2/c1-3-18-17-30-15-13-19(18)16-24(30)26(21-12-14-28-23-10-6-4-8-20(21)23)29-27(31)22-9-5-7-11-25(22)32-2/h3-12,14,18-19,24,26H,1,13,15-17H2,2H3,(H,29,31)/t18?,19-,24?,26+/m1/s1 |
| InChIKey | YVXDJFTVKSVNNS-RDWVHJTESA-N |
| Molecular Weight | 427.548 g/mol |
| SMILES | N(C(c1c(OC)cccc1)=O)[C@](C1N2CC([C@@](C1)(CC2)[H])C=C)(c1c2c(cccc2)ncc1)[H] |
| SPLASH | splash10-002u-2972500000-9bb37ff9b367dc38c3e1 |
| Source of Spectrum | F-62-6163-0 |
| Synonyms | N-[(9S)-cinchonan-9-yl]-2-methoxybenzamide |
| Wiley ID | 1633873 |