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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 75y0b9C36iR
Name CYCLOHEXANECARBOXYLIC ACID, 4-PROPYL-, 4-BUTOXY-2,3-DICYANOPHENYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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 368.2093
SMILES CCCC1CCC(C(Oc2c(C#N)c(C#N)c(OCCCC)cc2)=O)CC1
SPLASH splash10-05rr-9400000000-fc4982e9615658af4097
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany