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Cholesteryl n-heptanoate

View entire compound with spectra: 4 NMR, 2 FTIR, and 1 Raman

Cholesteryl n-heptanoate
SpectraBase Compound ID HggVzrDGEzQ
InChI InChI=1S/C34H58O2/c1-7-8-9-10-14-32(35)36-27-19-21-33(5)26(23-27)15-16-28-30-18-17-29(25(4)13-11-12-24(2)3)34(30,6)22-20-31(28)33/h15,24-25,27-31H,7-14,16-23H2,1-6H3/t25-,27+,28+,29-,30+,31+,33+,34-/m1/s1
InChIKey KXWDMNPRHKRGKB-DYQRUOQXSA-N
Mol Weight 498.8 g/mol
Molecular Formula C34H58O2
Exact Mass 498.443681 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID zu8SUjVayl
Name Heptanoic acid, cholesteryl ester
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H58O2
InChI InChI=1S/C34H58O2/c1-7-8-9-10-14-32(35)36-27-19-21-33(5)26(23-27)15-16-28-30-18-17-29(25(4)13-11-12-24(2)3)34(30,6)22-20-31(28)33/h15,24-25,27-31H,7-14,16-23H2,1-6H3/t25-,27+,28+,29-,30+,31+,33+,34-/m1/s1
InChIKey KXWDMNPRHKRGKB-DYQRUOQXSA-N
Melting Point 113C
Molecular Weight 498.84
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms CHOLESTEROL, HEPTANOATE