| SpectraBase Spectrum ID |
623aISQI1sj |
| Name |
citramalic acid, 3TMS |
| Comments |
Derivatization type: 3 TMS (mass: 364.156); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000122; Note: The molecular formula of the structure shown is C5H8O5 - which differs from the formula reported for the mass spectrum (C14H32O5Si3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H32O5Si3 |
| InChI |
InChI=1S/C14H32O5Si3/c1-14(19-22(8,9)10,13(16)18-21(5,6)7)11-12(15)17-20(2,3)4/h11H2,1-10H3/t14-/m1/s1 |
| InChIKey |
PQUDIQABDWAPQW-CQSZACIVSA-N |
| Molecular Weight |
364.660 g/mol |
| SMILES |
C[C@@](CC(=O)O[Si](C)(C)C)(C(=O)O[Si](C)(C)C)O[Si](C)(C)C |
| SPLASH |
splash10-0002-0920000000-b8f2f0473d7f640f78eb |
| Source of Spectrum |
FM-2019-122-0 |
| Synonyms |
D-Citramalic acid, 3TMS
D-Citramalate, 3TMS
2-Methylmalic acid, 3TMS
(3R)-Citramalate, 3TMS
(3R)-Citramalic acid, 3TMS
(R)-2-Methylmalate, 3TMS
(2R)-2-hydroxy-2-methylbutanedioic acid, 3TMS
bis(trimethylsilyl) (R)-2-methyl-2-((trimethylsilyl)oxy)succinate |
| Wiley ID |
1817816 |
