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2,4-dichlorobenzoic acid, cholesteryl ester

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2,4-dichlorobenzoic acid, cholesteryl ester
SpectraBase Compound ID FrMXTj3tTu6
InChI InChI=1S/C34H48Cl2O2/c1-21(2)7-6-8-22(3)28-13-14-29-26-11-9-23-19-25(38-32(37)27-12-10-24(35)20-31(27)36)15-17-33(23,4)30(26)16-18-34(28,29)5/h9-10,12,20-22,25-26,28-30H,6-8,11,13-19H2,1-5H3/t22-,25+,26+,28-,29+,30+,33+,34-/m1/s1
InChIKey NZZFKZMKJPWVDL-XBGNAKIGSA-N
Mol Weight 559.7 g/mol
Molecular Formula C34H48Cl2O2
Exact Mass 558.303136 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 1fwg1K5d2LR
Name 2,4-dichlorobenzoic acid, cholesteryl ester
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H48Cl2O2
InChI InChI=1S/C34H48Cl2O2/c1-21(2)7-6-8-22(3)28-13-14-29-26-11-9-23-19-25(38-32(37)27-12-10-24(35)20-31(27)36)15-17-33(23,4)30(26)16-18-34(28,29)5/h9-10,12,20-22,25-26,28-30H,6-8,11,13-19H2,1-5H3/t22-,25+,26+,28-,29+,30+,33+,34-/m1/s1
InChIKey NZZFKZMKJPWVDL-XBGNAKIGSA-N
Melting Point 131-133C (mesomorphic)
Molecular Weight 559.656006
Synonyms CHOLESTEROL, 2,4-DICHLOROBENZOATE BENZOIC ACID, 2,4-DICHLORO-, CHOLESTERYL ESTER
Technique KBr WAFER