| SpectraBase Spectrum ID |
G7b0BTpW4yE |
| Name |
N-acetyl-aspartic acid, 3TMS |
| Alternate Name(s) |
Acetylaspartic acid, 3TMS
N-Acetylaspartate, 3TMS
N-Acetyl-L-aspartic acid, 3TMS
N-Acetylaspartic acid, 3TMS
N-Acetyl-L-aspartate, 3TMS
(2S)-2-acetamidobutanedioic acid, 3TMS
bis(trimethylsilyl) N-acetyl-N-(trimethylsilyl)-L-aspartate |
| Comments |
Derivatization type: 3 TMS (mass: 391.167); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000002; Note: The molecular formula of the structure shown is C6H9NO5 - which differs from the formula reported for the mass spectrum (C15H33NO5Si3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H33NO5Si3 |
| InChI |
InChI=1S/C15H33NO5Si3/c1-12(17)16(22(2,3)4)13(15(19)21-24(8,9)10)11-14(18)20-23(5,6)7/h13H,11H2,1-10H3/t13-/m0/s1 |
| InChIKey |
YVINNGKTUCMQBE-ZDUSSCGKSA-N |
| Molecular Weight |
391.686 g/mol |
| SMILES |
CC(N([C@@](CC(=O)O[Si](C)(C)C)(C(=O)O[Si](C)(C)C)[H])[Si](C)(C)C)=O |
| SPLASH |
splash10-01x1-0930000000-32f8f26d982eed544c97 |
| Source of Spectrum |
FM-2019-2-0 |
| Wiley ID |
1817704 |
