| SpectraBase Spectrum ID |
G0tXDIY8GwI |
| Name |
panthenol, 3TMS |
| Alternate Name(s) |
Dexpanthenol, 3TMS
Bepanthene, 3TMS
Panthoderm, 3TMS
Pantothenol, 3TMS
Bepanthen, 3TMS
2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide, 3TMS
3,3-Dimethyl-2,4-bis((trimethylsilyl)oxy)-N-(3-((trimethylsilyl)oxy)propyl)butanamide |
| Comments |
Derivatization type: 3 TMS (mass: 421.25); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000743; Note: The molecular formula of the structure shown is C9H19NO4 - which differs from the formula reported for the mass spectrum (C18H43NO4Si3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H43NO4Si3 |
| InChI |
InChI=1S/C18H43NO4Si3/c1-18(2,15-22-25(6,7)8)16(23-26(9,10)11)17(20)19-13-12-14-21-24(3,4)5/h16H,12-15H2,1-11H3,(H,19,20) |
| InChIKey |
RTDGNGBVIBKDRU-UHFFFAOYSA-N |
| Molecular Weight |
421.800 g/mol |
| SMILES |
N(CCCO[Si](C)(C)C)C(C(C(C)(C)CO[Si](C)(C)C)O[Si](C)(C)C)=O |
| SPLASH |
splash10-0uxr-0910000000-8716a9ced564d7e962e8 |
| Source of Spectrum |
FM-2019-743-0 |
| Wiley ID |
1818419 |
