![BI[3ALPHA,6ALPHA-DIHYDROXY-24,24,25,25,26,26-HEXAFLUORO-27-NOR-5BETA-CHOLESTAN-26-YL]](/api/spectrum/CHnv0X0OzdI/structure.png?h=300&w=458 "BI[3ALPHA,6ALPHA-DIHYDROXY-24,24,25,25,26,26-HEXAFLUORO-27-NOR-5BETA-CHOLESTAN-26-YL]")
| SpectraBase Compound ID | Gmr47RlKaEs |
|---|---|
| InChI | InChI=1S/C52H78F12O4/c1-27(33-7-9-35-31-25-41(67)39-23-29(65)13-17-45(39,5)37(31)15-19-43(33,35)3)11-21-47(53,54)49(57,58)51(61,62)52(63,64)50(59,60)48(55,56)22-12-28(2)34-8-10-36-32-26-42(68)40-24-30(66)14-18-46(40,6)38(32)16-20-44(34,36)4/h27-42,65-68H,7-26H2,1-6H3/t27-,28-,29-,30-,31?,32?,33-,34-,35?,36?,37?,38?,39+,40+,41+,42+,43-,44-,45-,46-/m0/s1 |
| InChIKey | YCWMQFLETUCTKP-RDWGIUHASA-N |
| Mol Weight | 995.2 g/mol |
| Molecular Formula | C52H78F12O4 |
| Exact Mass | 994.570849 g/mol |
19F 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 | CHnv0X0OzdI |
|---|---|
| Name | BI[3ALPHA,6ALPHA-DIHYDROXY-24,24,25,25,26,26-HEXAFLUORO-27-NOR-5BETA-CHOLESTAN-26-YL] |
| Comments | EXTERNAL STANDARD - CF3COOH (76.8 FROM CFCL3). SCALE INVERTED. NAME |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C52H78F12O4 |
| InChI | InChI=1S/C52H78F12O4/c1-27(33-7-9-35-31-25-41(67)39-23-29(65)13-17-45(39,5)37(31)15-19-43(33,35)3)11-21-47(53,54)49(57,58)51(61,62)52(63,64)50(59,60)48(55,56)22-12-28(2)34-8-10-36-32-26-42(68)40-24-30(66)14-18-46(40,6)38(32)16-20-44(34,36)4/h27-42,65-68H,7-26H2,1-6H3/t27-,28-,29-,30-,31?,32?,33-,34-,35?,36?,37?,38?,39+,40+,41+,42+,43-,44-,45-,46-/m0/s1 |
| InChIKey | YCWMQFLETUCTKP-RDWGIUHASA-N |
| Instrument Name | Varian EM-360 |
| Literature Reference | WEI-YUAN HUANG, LI-QING HU, WEN-ZHE GE (1989) J.Fluor.Chem.: v.43, N3, 305-318. |
| NMR Standard | CCl3F |
| Observed nucleus | 19F |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | not reported |