| SpectraBase Spectrum ID |
DkKSWveLDbU |
| Name |
Bisacodyl-M/A (-AC) TMS |
| Classification |
Pharmaceutical drug metabolite derivative |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
391.160370201 u |
| Formula |
C23H25NO3Si |
| InChI |
InChI=1S/C23H25NO3Si/c1-17(25)26-20-12-8-18(9-13-20)23(22-7-5-6-16-24-22)19-10-14-21(15-11-19)27-28(2,3)4/h5-16,23H,1-4H3 |
| InChIKey |
TYGGKBXUBPAGNO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
391.542 g/mol |
| Nominal Mass |
391 u |
| Quality |
948 |
| Retention Index |
2983 |
| SMILES |
C(C1=CC=C(C=C1)OC(=O)C)(C=1C=CC(=CC1)O[Si](C)(C)C)C1=NC=CC=C1 |
| SPLASH |
splash10-0006-0129000000-aff2d1a28f3d7a3b2b9a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-Trimethylsilyl-4'-(2-pyridylmethylene)bisphenol acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_014215 |
