| SpectraBase Spectrum ID |
B0OnnhB0Hdw |
| Name |
Octaethyl dodec-6-en-4,8-diyn-1,1,2,2,11,11,12,12-octacarboxylate |
| Alternate Name(s) |
octaethyl (6E)-6-dodecene-4,8-diyne-1,1,2,2,11,11,12,12-octacarboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H48O16 |
| InChI |
InChI=1S/C36H48O16/c1-9-45-27(37)25(28(38)46-10-2)35(31(41)49-13-5,32(42)50-14-6)23-21-19-17-18-20-22-24-36(33(43)51-15-7,34(44)52-16-8)26(29(39)47-11-3)30(40)48-12-4/h17-18,25-26H,9-16,23-24H2,1-8H3/b18-17- |
| InChIKey |
XYLODNKFWXXMOM-ZCXUNETKSA-N |
| Molecular Weight |
736.764 g/mol |
| SMILES |
C(C(C(=O)OCC)C(=O)OCC)(C(=O)OCC)(C(=O)OCC)CC#C\C=C/C#CCC(C(C(=O)OCC)C(=O)OCC)(C(=O)OCC)C(=O)OCC |
| SPLASH |
splash10-000j-0700000900-0702b0c67e7932499c1a |
| Source of Spectrum |
SO-0-448-8 |
| Wiley ID |
873458 |
