| SpectraBase Spectrum ID |
5UPQMbKJU1U |
| Name |
Aspartic acid 3TMS |
| CAS Registry Number |
55268-53-6 |
| Classification |
Pharmaceutical drug derivative |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
349.156088083 u |
| Formula |
C13H31NO4Si3 |
| InChI |
InChI=1S/C13H31NO4Si3/c1-19(2,3)14-11(13(16)18-21(7,8)9)10-12(15)17-20(4,5)6/h11,14H,10H2,1-9H3 |
| InChIKey |
CTMXPIJTHHSEEF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
349.649 g/mol |
| Nominal Mass |
349 u |
| Quality |
981 |
| Retention Index |
2419 |
| SMILES |
C(C(O[Si](C)(C)C)=O)(N[Si](C)(C)C)CC(O[Si](C)(C)C)=O |
| SPLASH |
splash10-00e9-9660000000-e1ac43f21b8d008bebe2 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Bis(trimethylsilyl) (2S)-2-(trimethylsilylamino)butanedioate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_005642 |
