| SpectraBase Compound ID | 5gw4DoitgzR |
|---|---|
| InChI | InChI=1S/C25H31ClO5/c1-15(2)7-6-8-17(5)10-12-25(31)22(29)19-13-18(27)14-20(28)21(19)23(30)24(25,26)11-9-16(3)4/h7,9-10,13-14,27-28,31H,6,8,11-12H2,1-5H3/b17-10+/t24-,25-/m1/s1 |
| InChIKey | DRVVWOVFACYRGZ-VLRVHMGRSA-N |
| Mol Weight | 446.97 g/mol |
| Molecular Formula | C25H31ClO5 |
| Exact Mass | 446.186002 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4gZpOCYD0W9 |
|---|---|
| Name | NAPHTHOMEVALIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H31ClO5 |
| InChI | InChI=1S/C25H31ClO5/c1-15(2)7-6-8-17(5)10-12-25(31)22(29)19-13-18(27)14-20(28)21(19)23(30)24(25,26)11-9-16(3)4/h7,9-10,13-14,27-28,31H,6,8,11-12H2,1-5H3/b17-10+/t24-,25-/m1/s1 |
| InChIKey | DRVVWOVFACYRGZ-VLRVHMGRSA-N |
| Literature Reference Author | T.HANKEL,A.ZEECK |
| Literature Reference Citation | J.ANTIBIOTICS,44,665(1991) |
| Literature Reference DOI | 10.7164/antibiotics.44.665 |
| Molecular Weight | 446.971 g/mol |
| Sample ID | 66503 |
| Solvent | CDCl3 |