| SpectraBase Compound ID | KEIOBZo6PGf |
|---|---|
| InChI | InChI=1S/C22H25F3O13/c23-22(24,25)9-4-13(28)35-10-3-7(1-2-8(9)10)34-20-18(33)16(31)19(12(6-27)37-20)38-21-17(32)15(30)14(29)11(5-26)36-21/h1-4,11-12,14-21,26-27,29-33H,5-6H2/t11-,12-,14+,15+,16-,17-,18-,19-,20-,21+/m1/s1 |
| InChIKey | NJALVOVQJZTOPM-ZJSKFKIMSA-N |
| Mol Weight | 554.42 g/mol |
| Molecular Formula | C22H25F3O13 |
| Exact Mass | 554.124725 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IKVvYA5ISc7 |
|---|---|
| Name | 4-TRIFLUOROMETHYLUMBELLIFERYL BETA-LACTOSIDE |
| Comments | AS |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C22H25F3O13 |
| InChI | InChI=1S/C22H25F3O13/c23-22(24,25)9-4-13(28)35-10-3-7(1-2-8(9)10)34-20-18(33)16(31)19(12(6-27)37-20)38-21-17(32)15(30)14(29)11(5-26)36-21/h1-4,11-12,14-21,26-27,29-33H,5-6H2/t11-,12-,14+,15+,16-,17-,18-,19-,20-,21+/m1/s1 |
| InChIKey | NJALVOVQJZTOPM-ZJSKFKIMSA-N |
| Instrument Name | Bruker AM-300 |
| Literature Reference | YA.V.VOZNY, I.S.KALICHEVA, A.A.GALOYAN (1989) Bioorganich.Khim.(Russ. Lang.):v.15, N8, 1107-1112. |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | SEE COMMENT |