| SpectraBase Spectrum ID |
JUmAlcm1cqg |
| Name |
1,5-anydroglucitol, 4TMS |
| Alternate Name(s) |
Polygalytol, 4TMS
1,5-Anhydroglucitol, 4TMS
1,5-Anhydro-D-glucitol, 4TMS
1,5-Anhydro-D-sorbitol, 4TMS
1,5-ANHYDROSORBITOL, 4TMS
D-Glucitol, 1,5-anhydro-, 4TMS
(2R,3S,4R,5S)-2-(hydroxymethyl)oxane-3,4,5-triol, 4TMS
(((2R,3R,4R,5S)-2-(((trimethylsilyl)oxy)methyl)tetrahydro-2H-pyran-3,4,5-triyl)tris(oxy))tris(trimethylsilane) |
| Comments |
Derivatization type: 4 TMS (mass: 452.227); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000497; Note: The molecular formula of the structure shown is C6H12O5 - which differs from the formula reported for the mass spectrum (C18H44O5Si4) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H44O5Si4 |
| InChI |
InChI=1S/C18H44O5Si4/c1-24(2,3)20-14-15-17(22-26(7,8)9)18(23-27(10,11)12)16(13-19-15)21-25(4,5)6/h15-18H,13-14H2,1-12H3/t15-,16+,17-,18-/m1/s1 |
| InChIKey |
BKZSHWBRUJTUIK-XMTFNYHQSA-N |
| Molecular Weight |
452.885 g/mol |
| SMILES |
C([C@@]1([C@]([C@@]([C@](CO1)(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])[H])O[Si](C)(C)C |
| SPLASH |
splash10-0gb9-0900000000-3b72b858c9bcc30c45b1 |
| Source of Spectrum |
FM-2019-497-0 |
| Wiley ID |
1818181 |
