| SpectraBase Spectrum ID |
93aztGnMXLM |
| Name |
citraconic acid, 2TMS |
| Comments |
Derivatization type: 2 TMS (mass: 274.106); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000120; Note: The molecular formula of the structure shown is C5H6O4 - which differs from the formula reported for the mass spectrum (C11H22O4Si2) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H22O4Si2 |
| InChI |
InChI=1S/C11H22O4Si2/c1-9(11(13)15-17(5,6)7)8-10(12)14-16(2,3)4/h8H,1-7H3/b9-8+ |
| InChIKey |
SXLJYBIAHQEULW-CMDGGOBGSA-N |
| Molecular Weight |
274.463 g/mol |
| SMILES |
C\C(=C/C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C |
| SPLASH |
splash10-0002-1900000000-eb0b8930dd52f85376b0 |
| Source of Spectrum |
FM-2019-120-0 |
| Synonyms |
mesaconate, 2TMS
mesaconic acid, 2TMS
2-Methylfumarate, 2TMS
(E)-2-methyl-2-butanedionic acid, 2TMS
2-Butenedioic acid, 2-methyl-, (E)-, 2TMS
498-24-8, 2TMS
2-Methylbut-2-enedioic acid, 2TMS
bis(trimethylsilyl) 2-methylfumarate |
| Wiley ID |
1817814 |
