| SpectraBase Compound ID | Iwxr3O31CKF |
|---|---|
| InChI | InChI=1S/C20H21NO4.ClHO4/c1-21(2)15-4-11-6-17(22)18(23-3)8-13(11)16(21)5-12-7-19-20(9-14(12)15)25-10-24-19;2-1(3,4)5/h6-9,15-16H,4-5,10H2,1-3H3;(H,2,3,4,5)/t15-,16-;/m0./s1 |
| InChIKey | VJWLDFUXEGNQPT-MOGJOVFKSA-N |
| Mol Weight | 439.85 g/mol |
| Molecular Formula | C20H22ClNO8 |
| Exact Mass | 439.103394 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ql0m8LXy0L |
|---|---|
| Name | (-)-CARYACHINE-N-METHO-PERCHLORATE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H22ClNO8 |
| InChI | InChI=1S/C20H21NO4.ClHO4/c1-21(2)15-4-11-6-17(22)18(23-3)8-13(11)16(21)5-12-7-19-20(9-14(12)15)25-10-24-19;2-1(3,4)5/h6-9,15-16H,4-5,10H2,1-3H3;(H,2,3,4,5)/t15-,16-;/m0./s1 |
| InChIKey | VJWLDFUXEGNQPT-MOGJOVFKSA-N |
| Literature Reference Author | S.S.LEE,Y.C.LIU,C.H.CHEN |
| Literature Reference Citation | J.NAT.PROD.,53,1267(1990) |
| Literature Reference DOI | 10.1021/np50071a020 |
| Molecular Weight | 439.850 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWRU169 |