| SpectraBase Spectrum ID |
4WH7QFpd0C |
| Name |
panthenol, 4TMS |
| Comments |
Derivatization type: 4 TMS (mass: 493.29); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000742; Note: The molecular formula of the structure shown is C9H19NO4 - which differs from the formula reported for the mass spectrum (C21H51NO4Si4) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H51NO4Si4 |
| InChI |
InChI=1S/C21H51NO4Si4/c1-21(2,18-25-29(9,10)11)19(26-30(12,13)14)20(23)22(27(3,4)5)16-15-17-24-28(6,7)8/h19H,15-18H2,1-14H3 |
| InChIKey |
ZZAWRWQDIPZYRI-UHFFFAOYSA-N |
| Molecular Weight |
493.982 g/mol |
| SMILES |
CC(C)(CO[Si](C)(C)C)C(C(N(CCCO[Si](C)(C)C)[Si](C)(C)C)=O)O[Si](C)(C)C |
| SPLASH |
splash10-0f8a-0911000000-bb77c4d2b7a1a11ef126 |
| Source of Spectrum |
FM-2019-742-0 |
| Synonyms |
Dexpanthenol, 4TMS
Bepanthene, 4TMS
Panthoderm, 4TMS
Pantothenol, 4TMS
Bepanthen, 4TMS
2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide, 4TMS
3,3-Dimethyl-N-(trimethylsilyl)-2,4-bis((trimethylsilyl)oxy)-N-(3-((trimethylsilyl)oxy)propyl)butanamide |
| Wiley ID |
1818418 |
