SpectraBase Compound ID | qY1KTomMa0 |
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InChI | InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h17-24,28H,6-16H2,1-5H3/t18-,19+,20+,21-,22+,23+,24-,26-,27-/m1/s1 |
InChIKey | JQMQKOQOLPGBBE-ZNCJEFCDSA-N |
Mol Weight | 402.7 g/mol |
Molecular Formula | C27H46O2 |
Exact Mass | 402.349781 g/mol |
SpectraBase Spectrum ID | Dt8PAIq8ep8 |
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Name | 6-Ketocholestanol |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | K606 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C27H46O2 |
InChI | InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h17-24,28H,6-16H2,1-5H3/t18-,19+,20+,21-,22+,23+,24-,26-,27-/m1/s1 |
InChIKey | JQMQKOQOLPGBBE-ZNCJEFCDSA-N |
Molecular Weight | 402.663 g/mol |
Observed nucleus | 13C |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_13CNMR_015204 |