| SpectraBase Compound ID | Ejr4Rki8ZIu |
|---|---|
| InChI | InChI=1S/C45H66O4/c1-34(2)17-11-18-35(3)19-12-20-36(4)21-13-22-37(5)23-14-24-38(6)25-15-26-39(7)27-16-28-40(8)29-30-43-33-44(48-41(9)46)31-32-45(43)49-42(10)47/h17,19,21,23,25,27,29,31-33H,11-16,18,20,22,24,26,28,30H2,1-10H3/b35-19+,36-21+,37-23+,38-25+,39-27+,40-29+ |
| InChIKey | ZYBSMAOLBGZOQO-PSLAQMGLSA-N |
| Mol Weight | 671.0 g/mol |
| Molecular Formula | C45H66O4 |
| Exact Mass | 670.496111 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | I29hcMfI8VD |
|---|---|
| Name | Sarcohydroquinone - B Acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C45H66O4 |
| InChI | InChI=1S/C45H66O4/c1-34(2)17-11-18-35(3)19-12-20-36(4)21-13-22-37(5)23-14-24-38(6)25-15-26-39(7)27-16-28-40(8)29-30-43-33-44(48-41(9)46)31-32-45(43)49-42(10)47/h17,19,21,23,25,27,29,31-33H,11-16,18,20,22,24,26,28,30H2,1-10H3/b35-19+,36-21+,37-23+,38-25+,39-27+,40-29+ |
| InChIKey | ZYBSMAOLBGZOQO-PSLAQMGLSA-N |
| Molecular Weight | 671.019 g/mol |
| SMILES | c1(c(cc(OC(=O)C)cc1)C\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C)C)C)C)OC(=O)C |
| SPLASH | splash10-0udv-0984312000-2d40205b7bc3163ef001 |
| Source of Spectrum | X2-55-1259-5 |
| Wiley ID | 1604601 |