| SpectraBase Spectrum ID |
5ZS6yiF707M |
| Name |
Nicotinic acid TMS |
| CAS Registry Number |
25436-37-7 |
| Classification |
Drug derivative |
| Comments |
Spectrum verified by crosschecking against external libraries (two 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 |
195.071555196 u |
| Formula |
C9H13NO2Si |
| InChI |
InChI=1S/C9H13NO2Si/c1-13(2,3)12-9(11)8-5-4-6-10-7-8/h4-7H,1-3H3 |
| InChIKey |
PYFBRRMHOWLGJH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
195.293 g/mol |
| Nominal Mass |
195 u |
| Quality |
997 |
| Retention Index |
1433 |
| SMILES |
C(O[Si](C)(C)C)(C1=CC=CN=C1)=O |
| SPLASH |
splash10-0540-5900000000-e11f3b7d1060da830245 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Niacin TMS
3-Pyridinecarboxylic acid,trimethylsilyl ester
Trimethylsilyl nicotinate
Trimethylsilyl-pyridine-3-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021687 |
