| SpectraBase Compound ID | 8uQOfSUXwsH |
|---|---|
| InChI | InChI=1S/C34H45F3O23/c35-34(36,37)11-4-17(42)53-12-3-9(1-2-10(11)12)52-30-24(49)20(45)27(14(6-39)55-30)59-32-26(51)22(47)29(16(8-41)57-32)60-33-25(50)21(46)28(15(7-40)56-33)58-31-23(48)19(44)18(43)13(5-38)54-31/h1-4,13-16,18-33,38-41,43-51H,5-8H2/t13-,14-,15-,16-,18-,19+,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31+,32+,33+/m1/s1 |
| InChIKey | VDQDZNREGMLEHI-TYAPNKPCSA-N |
| Mol Weight | 878.7 g/mol |
| Molecular Formula | C34H45F3O23 |
| Exact Mass | 878.230372 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7k5E9zzXico |
|---|---|
| Name | 4-TRIFLUOROMETHYLUMBELLIFERYL BETA-D-CELLOTETRAOSIDE |
| Comments | ST |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C34H45F3O23 |
| InChI | InChI=1S/C34H45F3O23/c35-34(36,37)11-4-17(42)53-12-3-9(1-2-10(11)12)52-30-24(49)20(45)27(14(6-39)55-30)59-32-26(51)22(47)29(16(8-41)57-32)60-33-25(50)21(46)28(15(7-40)56-33)58-31-23(48)19(44)18(43)13(5-38)54-31/h1-4,13-16,18-33,38-41,43-51H,5-8H2/t13-,14-,15-,16-,18-,19+,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31+,32+,33+/m1/s1 |
| InChIKey | VDQDZNREGMLEHI-TYAPNKPCSA-N |
| Instrument Name | Bruker AM-300 |
| Literature Reference | YA.V.VOZNY, I.S.KALICHEVA, A.A.GALOYAN (1987) Bioorganich.Khim.(Russ. Lang.):v.13, N12, 1659-1664. |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | SEE COMMENT |