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4-Butoxy-2,3-dicyanophenyl 4-butylcyclohexanecarboxylate
SpectraBase Compound ID IcbuGpjyx20
InChI InChI=1S/C23H30N2O3/c1-3-5-7-17-8-10-18(11-9-17)23(26)28-22-13-12-21(27-14-6-4-2)19(15-24)20(22)16-25/h12-13,17-18H,3-11,14H2,1-2H3
InChIKey VYKAODSMVPMUAT-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 3VSuYPTmLOx
Name CYCLOHEXANECARBOXYLIC ACID, 4-BUTYL-, 4-BUTOXY-2,3-DICYANOPHENYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H30N2O3
InChI InChI=1S/C23H30N2O3/c1-3-5-7-17-8-10-18(11-9-17)23(26)28-22-13-12-21(27-14-6-4-2)19(15-24)20(22)16-25/h12-13,17-18H,3-11,14H2,1-2H3
InChIKey VYKAODSMVPMUAT-UHFFFAOYSA-N
Molecular Weight 382.2249
SMILES CCCCC1CCC(C(Oc2ccc(OCCCC)c(C#N)c2C#N)=O)CC1
SPLASH splash10-053r-9200000000-d6ee6e68b2820795d371
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany