| SpectraBase Compound ID | KiYb6SWt4xe |
|---|---|
| InChI | InChI=1S/C36H53NO4/c1-23(2)9-8-10-24(3)28-16-17-29-27-15-18-31-34(4,5)32(20-22-36(31,7)30(27)19-21-35(28,29)6)41-33(38)25-11-13-26(14-12-25)37(39)40/h11-14,18,23-24,27-30,32H,8-10,15-17,19-22H2,1-7H3/t24-,27+,28-,29+,30+,32+,35-,36-/m1/s1 |
| InChIKey | ZMQWKMXCCCFGGS-VCNURGMYSA-N |
| Mol Weight | 563.8 g/mol |
| Molecular Formula | C36H53NO4 |
| Exact Mass | 563.397459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8kimAZ7DeOy |
|---|---|
| Name | 4,4-DIMETHYL-CHOLESTEROL-PARA-NITROBENZOATE-ESTER |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H53NO4 |
| InChI | InChI=1S/C36H53NO4/c1-23(2)9-8-10-24(3)28-16-17-29-27-15-18-31-34(4,5)32(20-22-36(31,7)30(27)19-21-35(28,29)6)41-33(38)25-11-13-26(14-12-25)37(39)40/h11-14,18,23-24,27-30,32H,8-10,15-17,19-22H2,1-7H3/t24-,27+,28-,29+,30+,32+,35-,36-/m1/s1 |
| InChIKey | ZMQWKMXCCCFGGS-VCNURGMYSA-N |
| Literature Reference Author | E.BERMAN,N.FRIEDMAN,Y.MAZUR,M.SHEVES |
| Literature Reference Citation | J.AM.CHEM.SOC.,100,5626(1978) |
| Literature Reference DOI | 10.1021/ja00486a008 |
| Molecular Weight | 563.821 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWWR5081 |