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2,3-Dicyano-4-(pentyloxy)phenyl 4-pentylcyclohexanecarboxylate
SpectraBase Compound ID 4w2PrfPD3D9
InChI InChI=1S/C25H34N2O3/c1-3-5-7-9-19-10-12-20(13-11-19)25(28)30-24-15-14-23(29-16-8-6-4-2)21(17-26)22(24)18-27/h14-15,19-20H,3-13,16H2,1-2H3
InChIKey FTLQVFUGWANXKV-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C25H34N2O3
Exact Mass 410.256943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Advox9MIFHi
Name 2,3-Dicyano-4-(pentyloxy)phenyl 4-pentylcyclohexanecarboxylate
Alternate Name(s) (2,3-dicyano-4-pentoxy-phenyl) 4-pentylcyclohexane-1-carboxylate (2,3-dicyano-4-pentoxy-phenyl) 4-pentylcyclohexanecarboxylate 4-Amylcyclohexanecarboxylic acid (4-amoxy-2,3-dicyano-phenyl) ester 4-Pentyl-1-cyclohexanecarboxylic acid (2,3-dicyano-4-pentoxyphenyl) ester Cyclohexanecarboxylic acid, 4-pentyl-, 2,3-dicyano-4-(pentyloxy)phenyl ester
CAS Registry Number 75941-52-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34N2O3
InChI InChI=1S/C25H34N2O3/c1-3-5-7-9-19-10-12-20(13-11-19)25(28)30-24-15-14-23(29-16-8-6-4-2)21(17-26)22(24)18-27/h14-15,19-20H,3-13,16H2,1-2H3
InChIKey FTLQVFUGWANXKV-UHFFFAOYSA-N
Molecular Weight 410.558 g/mol
SMILES CCCCCC1CCC(CC1)C(=O)Oc1ccc(c(c1C#N)C#N)OCCCCC
SPLASH splash10-000w-9200000000-08403226944d6f0fa215
Source of Spectrum O-26-145-35
Wiley ID 1373766