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2,3-Dicyano-4-(pentyloxy)phenyl 4-butylcyclohexanecarboxylate
SpectraBase Compound ID 9MUDgGHHOXd
InChI InChI=1S/C24H32N2O3/c1-3-5-7-15-28-22-13-14-23(21(17-26)20(22)16-25)29-24(27)19-11-9-18(10-12-19)8-6-4-2/h13-14,18-19H,3-12,15H2,1-2H3
InChIKey PGEGFUGXXXMXOM-UHFFFAOYSA-N
Mol Weight 396.5 g/mol
Molecular Formula C24H32N2O3
Exact Mass 396.241293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8gjCEDUTkb9
Name CYCLOHEXANECARBOXYLIC ACID, 4-BUTYL-, 2,3-DICYANO-4-(PENTYLOXY)PHENYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H32N2O3
InChI InChI=1S/C24H32N2O3/c1-3-5-7-15-28-22-13-14-23(21(17-26)20(22)16-25)29-24(27)19-11-9-18(10-12-19)8-6-4-2/h13-14,18-19H,3-12,15H2,1-2H3
InChIKey PGEGFUGXXXMXOM-UHFFFAOYSA-N
Molecular Weight 396.2405
SMILES CCCCC1CCC(C(Oc2ccc(OCCCCC)c(C#N)c2C#N)=O)CC1
SPLASH splash10-053u-9200000000-d4c9e995b456742a4705
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany