| SpectraBase Compound ID | JRXmJTxjn3Z |
|---|---|
| InChI | InChI=1S/C42H60O2S3/c1-25(43)31-11-13-33-29-9-7-27-23-41(21-19-37(27,3)35(29)15-17-39(31,33)5)45-42(47-46-41)22-20-38(4)28(24-42)8-10-30-34-14-12-32(26(2)44)40(34,6)18-16-36(30)38/h23-24,29-36H,7-22H2,1-6H3/t29-,30-,31+,32+,33-,34-,35-,36-,37-,38-,39+,40+,41?,42?/m0/s1 |
| InChIKey | OZIUKOYPGBRBHE-APZZFNGPSA-N |
| Mol Weight | 693.1 g/mol |
| Molecular Formula | C42H60O2S3 |
| Exact Mass | 692.375545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1I5ZVyjHZVt |
|---|---|
| Name | OZIUKOYPGBRBHE-APZZFNGPSA-N |
| Compound Number | 5D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H60O2S3 |
| InChI | InChI=1S/C42H60O2S3/c1-25(43)31-11-13-33-29-9-7-27-23-41(21-19-37(27,3)35(29)15-17-39(31,33)5)45-42(47-46-41)22-20-38(4)28(24-42)8-10-30-34-14-12-32(26(2)44)40(34,6)18-16-36(30)38/h23-24,29-36H,7-22H2,1-6H3/t29-,30-,31+,32+,33-,34-,35-,36-,37-,38-,39+,40+,41?,42?/m0/s1 |
| InChIKey | OZIUKOYPGBRBHE-APZZFNGPSA-N |
| Literature Reference Author | N.M.KRSTIC,M.S.BJELAKOVIC,M.M.DABOVIC,V.D.PAVLOVIC |
| Literature Reference Citation | MOLECULES,15,3462(2010) |
| Literature Reference DOI | 10.3390/molecules15053462 |
| Molecular Weight | 693.117 g/mol |
| Sample ID | 70914 |
| Solvent | CDCl3 |