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4-Butoxy-2,3-dicyanophenyl 4-propylcyclohexanecarboxylate
SpectraBase Compound ID DfAJbdv63RS
InChI InChI=1S/C22H28N2O3/c1-3-5-13-26-20-11-12-21(19(15-24)18(20)14-23)27-22(25)17-9-7-16(6-4-2)8-10-17/h11-12,16-17H,3-10,13H2,1-2H3
InChIKey DDGSOQIGDXISGG-UHFFFAOYSA-N
Mol Weight 368.48 g/mol
Molecular Formula C22H28N2O3
Exact Mass 368.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IKII6PHMODR
Name 4-Butoxy-2,3-dicyanophenyl 4-propylcyclohexanecarboxylate
CAS Registry Number 75941-67-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28N2O3
InChI InChI=1S/C22H28N2O3/c1-3-5-13-26-20-11-12-21(19(15-24)18(20)14-23)27-22(25)17-9-7-16(6-4-2)8-10-17/h11-12,16-17H,3-10,13H2,1-2H3
InChIKey DDGSOQIGDXISGG-UHFFFAOYSA-N
Molecular Weight 368.477 g/mol
SMILES CCCC1CCC(CC1)C(=O)Oc1ccc(c(c1C#N)C#N)OCCCC
SPLASH splash10-05rr-9400000000-9a7c833c88e9e9b5e931
Source of Spectrum O-26-145-29
Synonyms (4-butoxy-2,3-dicyano-phenyl) 4-propylcyclohexane-1-carboxylate 4-Propyl-1-cyclohexanecarboxylic acid (4-butoxy-2,3-dicyanophenyl) ester 4-Propylcyclohexanecarboxylic acid (4-butoxy-2,3-dicyano-phenyl) ester Cyclohexanecarboxylic acid, 4-propyl-, 4-butoxy-2,3-dicyanophenyl ester (4-butoxy-2,3-dicyanophenyl) 4-propylcyclohexane-1-carboxylate
Wiley ID 1353249