| SpectraBase Spectrum ID |
2nxCSYfARpw |
| Name |
Salicyluric acid 2TMS |
| CAS Registry Number |
55887-56-4 |
| Classification |
Acetyl salicylic acid metabolite |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
339.132211355 u |
| Formula |
C15H25NO4Si2 |
| InChI |
InChI=1S/C15H25NO4Si2/c1-21(2,3)19-13-10-8-7-9-12(13)15(18)16-11-14(17)20-22(4,5)6/h7-10H,11H2,1-6H3,(H,16,18) |
| InChIKey |
YWJABPMELDZKDW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
339.538 g/mol |
| Nominal Mass |
339 u |
| Quality |
992 |
| Retention Index |
2449 |
| SMILES |
C1(C(NCC(O[Si](C)(C)C)=O)=O)=C(O[Si](C)(C)C)C=CC=C1 |
| SPLASH |
splash10-05fu-6965000000-395b4663453f8d39aa4d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-Hydroxyhippuricacid,trimethylsilyl ether,trimethylsilyl ester
N-[2-[(Trimethylsilyl)oxy]benzoyl]-glycine-trimethylsilyl ester |
| Technique |
GC/MS |
| Wiley ID |
DD2024_005612 |
![Trimethylsilyl ((2-[(trimethylsilyl)oxy]benzoyl)amino)acetate](/api/spectrum/2nxCSYfARpw/structure.png?h=300&w=458 "Trimethylsilyl ((2-[(trimethylsilyl)oxy]benzoyl)amino)acetate")
