| SpectraBase Spectrum ID |
J72a3adPeZw |
| Name |
threo-beta hydroxyaspartate, 3TMS |
| Alternate Name(s) |
3-Hydroxyaspartic acid, 3TMS
Malic acid, 3-amino-, 3TMS
Spectrum_001134, 3TMS
beta-Hydroxyaspartic acid, 3TMS
Spectrum2_001914, 3TMS
Spectrum3_001123, 3TMS
threo-beta-hydroxyaspartate, 3TMS
2-Amino-3-hydroxybutanedioic acid, 3TMS
bis(trimethylsilyl) 2-amino-3-((trimethylsilyl)oxy)succinate |
| Comments |
Derivatization type: 3 TMS (mass: 365.151); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000933; Note: The molecular formula of the structure shown is C4H7NO5 - which differs from the formula reported for the mass spectrum (C13H31NO5Si3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H31NO5Si3 |
| InChI |
InChI=1S/C13H31NO5Si3/c1-20(2,3)17-11(13(16)19-22(7,8)9)10(14)12(15)18-21(4,5)6/h10-11H,14H2,1-9H3 |
| InChIKey |
ZAKWVDSPUXMOIW-UHFFFAOYSA-N |
| Molecular Weight |
365.648 g/mol |
| SMILES |
NC(C(C(=O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C |
| SPLASH |
splash10-0f7k-0920000000-dbdcf9a3a321efd9afef |
| Source of Spectrum |
FM-2019-933-0 |
| Wiley ID |
1818599 |
