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2,3-Dicyano-4-ethoxyphenyl 4-hexylcyclohexanecarboxylate
SpectraBase Compound ID 5ncPZs5sFUx
InChI InChI=1S/C23H30N2O3/c1-3-5-6-7-8-17-9-11-18(12-10-17)23(26)28-22-14-13-21(27-4-2)19(15-24)20(22)16-25/h13-14,17-18H,3-12H2,1-2H3
InChIKey IDWKXQRFOHREBK-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C23H30N2O3
Exact Mass 382.225643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5RKghCFrGZR
Name CYCLOHEXANECARBOXYLIC ACID, 4-HEXYL-, 2,3-DICYANO-4-ETHOXYPHENYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H30N2O3
InChI InChI=1S/C23H30N2O3/c1-3-5-6-7-8-17-9-11-18(12-10-17)23(26)28-22-14-13-21(27-4-2)19(15-24)20(22)16-25/h13-14,17-18H,3-12H2,1-2H3
InChIKey IDWKXQRFOHREBK-UHFFFAOYSA-N
Molecular Weight 382.2249
SMILES CCCCCCC1CCC(C(Oc2c(C#N)c(C#N)c(OCC)cc2)=O)CC1
SPLASH splash10-090s-9400000000-fce3730177a5c47b26c5
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany