SpectraBase Compound ID | AE80BALbHuJ |
---|---|
InChI | InChI=1S/C32H50O4/c1-25(17-11-19-27(3)21-13-23-29(5)31(33)35-7)15-9-10-16-26(2)18-12-20-28(4)22-14-24-30(6)32(34)36-8/h15-16,19-20,23-24H,9-14,17-18,21-22H2,1-8H3/b25-15+,26-16+,27-19+,28-20+,29-23+,30-24+ |
InChIKey | HKMQYCVKLMTEJL-LULCRCFASA-N |
Mol Weight | 498.7 g/mol |
Molecular Formula | C32H50O4 |
Exact Mass | 498.37091 g/mol |
SpectraBase Spectrum ID | 5t4SscYk2ZI |
---|---|
Name | Dimethyl (all-E)squalene-1,24-dioate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C32H50O4 |
InChI | InChI=1S/C32H50O4/c1-25(17-11-19-27(3)21-13-23-29(5)31(33)35-7)15-9-10-16-26(2)18-12-20-28(4)22-14-24-30(6)32(34)36-8/h15-16,19-20,23-24H,9-14,17-18,21-22H2,1-8H3/b25-15+,26-16+,27-19+,28-20+,29-23+,30-24+ |
InChIKey | HKMQYCVKLMTEJL-LULCRCFASA-N |
Molecular Weight | 498.748 g/mol |
SMILES | C(\C(=C\CC\C(=C\CC\C(=C\CC\C=C\(CC\C=C\(CC\C=C\(C(=O)OC)C)C)C)C)C)C)(=O)OC |
SPLASH | splash10-0007-9500200000-486326edcc95505dad0e |
Source of Spectrum | AT-38-386-9 |
Wiley ID | 853763 |