| SpectraBase Spectrum ID |
DjkIBEFe5se |
| Name |
Benzoic acid TMS |
| CAS Registry Number |
2078-12-8 |
| Classification |
Pharmaceutical 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 |
194.076306224 u |
| Formula |
C10H14O2Si |
| InChI |
InChI=1S/C10H14O2Si/c1-13(2,3)12-10(11)9-7-5-4-6-8-9/h4-8H,1-3H3 |
| InChIKey |
VFFKJOXNCSJSAQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
194.305 g/mol |
| Nominal Mass |
194 u |
| Quality |
989 |
| Retention Index |
1362 |
| SMILES |
C(O[Si](C)(C)C)(C=1C=CC=CC1)=O |
| SPLASH |
splash10-056r-5900000000-2d23f1847369f037f964 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Trimethylsilyl benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007478 |
