| SpectraBase Compound ID | 4NBspgNaRQ7 |
|---|---|
| InChI | InChI=1S/C17H22NO5.BrH/c1-18(21)13-7-11(8-14(18)16-15(13)23-16)22-17(20)12(9-19)10-5-3-2-4-6-10;/h2-6,11-16,19,21H,7-9H2,1H3;1H/q+1;/p-1/t11-,12-,13-,14+,15-,16+,18?;/m1./s1 |
| InChIKey | STZDTFMLWULJQG-FDJOISAFSA-M |
| Mol Weight | 399.26 g/mol |
| Molecular Formula | C17H21BrNO5 |
| Exact Mass | 398.060311 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8B97I3qY8hd |
|---|---|
| Name | SCOPOLAMINE-N-OXIDE-HBR |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H21BrNO5 |
| InChI | InChI=1S/C17H22NO5.BrH/c1-18(21)13-7-11(8-14(18)16-15(13)23-16)22-17(20)12(9-19)10-5-3-2-4-6-10;/h2-6,11-16,19,21H,7-9H2,1H3;1H/q+1;/p-1/t11-,12-,13-,14+,15-,16+,18?;/m1./s1 |
| InChIKey | STZDTFMLWULJQG-FDJOISAFSA-M |
| Literature Reference Author | R.GLASER,D.SHIFTAN |
| Literature Reference Citation | J.ORG.CHEM.,64,9217(1999) |
| Literature Reference DOI | 10.1021/jo9912956 |
| Molecular Weight | 399.261 g/mol |
| Sample ID | 46089 |
| Solvent | SOLID-STATE |