| SpectraBase Spectrum ID |
K965RFOUjn6 |
| Name |
sorbose, 5TMS |
| Alternate Name(s) |
L-sorbose, 5TMS
Sorbinose, 5TMS
Esorben, 5TMS
Sorbin, 5TMS
L-Sorbinose, 5TMS
(3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one, 5TMS
(6S,7R,8S)-2,2,11,11-tetramethyl-6,7,8-tris((trimethylsilyl)oxy)-3,10-dioxa-2,11-disiladodecan-5-one |
| Comments |
Derivatization type: 5 TMS (mass: 540.261); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000357; Note: The molecular formula of the structure shown is C6H12O6 - which differs from the formula reported for the mass spectrum (C21H52O6Si5) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H52O6Si5 |
| InChI |
InChI=1S/C21H52O6Si5/c1-28(2,3)23-16-18(22)20(26-31(10,11)12)21(27-32(13,14)15)19(25-30(7,8)9)17-24-29(4,5)6/h19-21H,16-17H2,1-15H3/t19-,20+,21+/m0/s1 |
| InChIKey |
LDUCAYFXHYLHLP-PWRODBHTSA-N |
| Molecular Weight |
541.066 g/mol |
| SMILES |
C([C@@]([C@]([C@@](C(CO[Si](C)(C)C)=O)(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])O[Si](C)(C)C |
| SPLASH |
splash10-0udi-0920000000-1f19b48d29928c78a7de |
| Source of Spectrum |
FM-2019-357-0 |
| Wiley ID |
1818044 |
