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4-Butylphenyl 4-butylcyclohexanecarboxylate
SpectraBase Compound ID 2sur9lBngEf
InChI InChI=1S/C21H32O2/c1-3-5-7-17-9-13-19(14-10-17)21(22)23-20-15-11-18(12-16-20)8-6-4-2/h11-12,15-17,19H,3-10,13-14H2,1-2H3
InChIKey FJKYETMKDMANCX-UHFFFAOYSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gGJDT4uy55
Name 4-Butylphenyl 4-butylcyclohexanecarboxylate
CAS Registry Number 70602-94-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-3-5-7-17-9-13-19(14-10-17)21(22)23-20-15-11-18(12-16-20)8-6-4-2/h11-12,15-17,19H,3-10,13-14H2,1-2H3
InChIKey FJKYETMKDMANCX-UHFFFAOYSA-N
Molecular Weight 316.485 g/mol
SMILES c1c(ccc(OC(C2CCC(CCCC)CC2)=O)c1)CCCC
SPLASH splash10-0pw9-6900000000-9c481cdb7d31dbc8e98c
Synonyms (4-butylphenyl) 4-butylcyclohexane-1-carboxylate 4-Butyl-1-cyclohexanecarboxylic acid (4-butylphenyl) ester 4-Butylcyclohexanecarboxylic acid (4-butylphenyl) ester Cyclohexanecarboxylic acid, 4-butyl-, 4-butylphenyl ester
Wiley ID 1476060