| SpectraBase Compound ID | 88Dz2fyzLp3 |
|---|---|
| InChI | InChI=1S/C22H26N4/c1-25-13-11-21(15-7-3-5-9-17(15)23-19(21)25)22-12-14-26(2)20(22)24-18-10-6-4-8-16(18)22/h3-10,19-20,23-24H,11-14H2,1-2H3 |
| InChIKey | HOYXPMHLHJOGHD-UHFFFAOYSA-N |
| Mol Weight | 346.48 g/mol |
| Molecular Formula | C22H26N4 |
| Exact Mass | 346.215747 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | F2gr2GbbXbl |
|---|---|
| Name | Calycanthidine, 1-demethyl- |
| CAS Registry Number | 5545-89-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H26N4 |
| InChI | InChI=1S/C22H26N4/c1-25-13-11-21(15-7-3-5-9-17(15)23-19(21)25)22-12-14-26(2)20(22)24-18-10-6-4-8-16(18)22/h3-10,19-20,23-24H,11-14H2,1-2H3 |
| InChIKey | HOYXPMHLHJOGHD-UHFFFAOYSA-N |
| Molecular Weight | 346.478 g/mol |
| SMILES | N1c2c(C3(C45C(N(CC5)C)Nc5c4cccc5)C1N(C)CC3)cccc2 |
| SPLASH | splash10-00di-0900000000-09a3a23f29e48c185883 |
| Source of Spectrum | AD-0-852-0 |
| Synonyms | (-)-Chimonanthine 1-Demethylcalycanthidine Calycanthidine, 1-demethyl-, (.+-.)- 3-Methyl-8b-(3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl)-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole 3-Methyl-8b-(3-methyl-1,2,3a,4-tetrahydropyrrol[2,3-b]indol-8b-yl)-1,2,3a,4-tetrahydropyrrol[2,3-b]indole 3a.alpha.,8a.beta.-Chimonanthine Calycanthidine, 1-demethyl-, (2.beta.,3.beta.)- Calycanthidine, 1-demethyl-, (.+/-.)- Chimonanthin Chimonanthine, (.+-.)- Chimonanthine, (.+/-.)- |
| Wiley ID | 51481 |