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Cholesterol, p-nitrobenzoate

Compound with spectra: 3 NMR, and 1 FTIR

Cholesterol, p-nitrobenzoate
SpectraBase Compound ID 7m0HQxPj1Nm
InChI InChI=1S/C34H49NO4/c1-22(2)7-6-8-23(3)29-15-16-30-28-14-11-25-21-27(17-19-33(25,4)31(28)18-20-34(29,30)5)39-32(36)24-9-12-26(13-10-24)35(37)38/h9-13,22-23,27-31H,6-8,14-21H2,1-5H3/t23-,27+,28+,29-,30+,31+,33+,34-/m1/s1
InChIKey MCSXGHLTXBACQB-AESKLMAPSA-N
Mol Weight 535.8 g/mol
Molecular Formula C34H49NO4
Exact Mass 535.366159 g/mol
Enantiomer InChIKey MCSXGHLTXBACQB-WKLLBHEUSA-N

View Spectrum of Cholesterol, p-nitrobenzoate

13C NMR Spectrum
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Eastman Organic Chemicals, Rochester, New York
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20

View Spectrum of Cholesterol, p-nitrobenzoate

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of Cholesterol, p-nitrobenzoate

1H NMR Spectrum
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent CDCl3

View Spectrum of Cholesterol, p-nitrobenzoate

FTIR Spectrum
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample EASTMAN ORGANIC CHEMICALS, ROCHESTER, NEW YORK
Technique FILM (CAST FROM CHCl3)
  • CHOLESTEROL-PARA-NITROBENZOATE-ESTER;(VITAMIN-D-DERIVATIVE)
EPI-CHOLESTEROL-PARA-NITROBENZOATE-ESTER;(VITAMIN-D-DERIVATIVE)
3-CHOLESTERYL-PARA-AMINOBENZOATE;(CAB)
3-CHOLESTERYL-PARA-ISOCYANOBENZOATE;(CIB)
CHOLEST-5-EN-3-YL BENZOATE
(3.beta)-26,27-Dinorergost-5-en-3-ol benzoate
26,27-Dinorergost-5-en-3-ol, benzoate, (3.beta.)-
.beta.-Sitosterol 4-Methylbenzoate dev
.beta.-Sitosterol 4-Anisoylbenzoate dev
3.beta.Benzoyl- .beta.-sitosterol
24-Ethylcholesterol, benzoate (isomer)
Title Journal or Book Year
Conformational analysis of vitamin D and analogs. 1. Carbon-13 and proton nuclear magnetic resonance study The Journal of Organic Chemistry 1977
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