| SpectraBase Spectrum ID |
2nPduogwXQW |
| Name |
Aconitic acid 3TMS |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
390.135018285 u |
| Formula |
C15H30O6Si3 |
| InChI |
InChI=1S/C15H30O6Si3/c1-22(2,3)19-13(16)10-12(15(18)21-24(7,8)9)11-14(17)20-23(4,5)6/h10H,11H2,1-9H3/b12-10+ |
| InChIKey |
RHDPKJMZPKZKTA-ZRDIBKRKSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
390.654 g/mol |
| Nominal Mass |
390 u |
| Quality |
964 |
| Retention Index |
1764 |
| SMILES |
C(\C(=C\C(O[Si](C)(C)C)=O)CC(O[Si](C)(C)C)=O)(O[Si](C)(C)C)=O |
| SPLASH |
splash10-0092-6981000000-17f735deb4b0fcb4878f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
tris(trimethylsilyl) (1E)-prop-1-ene-1,2,3-tricarboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_018210 |
