| SpectraBase Compound ID | 7pYnTx8ZPXi |
|---|---|
| InChI | InChI=1S/C37H64O31/c1-57-32-22(52)16(46)27(9(3-39)59-32)65-34-24(54)18(48)29(11(5-41)61-34)67-36-26(56)20(50)31(13(7-43)63-36)68-37-25(55)19(49)30(12(6-42)62-37)66-35-23(53)17(47)28(10(4-40)60-35)64-33-21(51)15(45)14(44)8(2-38)58-33/h8-56H,2-7H2,1H3/t8-,9+,10-,11-,12-,13+,14-,15+,16+,17-,18-,19-,20+,21-,22+,23-,24-,25-,26+,27+,28-,29-,30-,31+,32+,33+,34+,35+,36-,37+/m0/s1 |
| InChIKey | FNHWMWRCNAUCDG-ASRHJFSLSA-N |
| Mol Weight | 1004.9 g/mol |
| Molecular Formula | C37H64O31 |
| Exact Mass | 1004.343155 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | L4dF0vUsnXA |
|---|---|
| Name | METHYL-BETA-D-CELLOHEXAOSE |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H64O31 |
| InChI | InChI=1S/C37H64O31/c1-57-32-22(52)16(46)27(9(3-39)59-32)65-34-24(54)18(48)29(11(5-41)61-34)67-36-26(56)20(50)31(13(7-43)63-36)68-37-25(55)19(49)30(12(6-42)62-37)66-35-23(53)17(47)28(10(4-40)60-35)64-33-21(51)15(45)14(44)8(2-38)58-33/h8-56H,2-7H2,1H3/t8-,9+,10-,11-,12-,13+,14-,15+,16+,17-,18-,19-,20+,21-,22+,23-,24-,25-,26+,27+,28-,29-,30-,31+,32+,33+,34+,35+,36-,37+/m0/s1 |
| InChIKey | FNHWMWRCNAUCDG-ASRHJFSLSA-N |
| Literature Reference Author | L.A.FLUGGE,J.T.BLANK,P.A.PETILLO |
| Literature Reference Citation | J.AM.CHEM.SOC.,121,7228(1999) |
| Literature Reference DOI | 10.1021/ja990561u |
| Molecular Weight | 1004.897 g/mol |
| Solvent | D2O |
| Source File Reference | UWRU11449 |