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6-Cyano-naphthalene-2-carboxylic acid, 4-hexyl-phenyl ester

View entire compound with spectra: 1 NMR, and 2 MS (GC)

6-Cyano-naphthalene-2-carboxylic acid, 4-hexyl-phenyl ester
SpectraBase Compound ID IJRcKLt4XQp
InChI InChI=1S/C24H23NO2/c1-2-3-4-5-6-18-8-13-23(14-9-18)27-24(26)22-12-11-20-15-19(17-25)7-10-21(20)16-22/h7-16H,2-6H2,1H3
InChIKey QYKIOSWQBXNQKF-UHFFFAOYSA-N
Mol Weight 357.45 g/mol
Molecular Formula C24H23NO2
Exact Mass 357.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 901Md8gJcBG
Name 6-CYANONAPHTHALENE-2-CARBOXYLIC ACID, 4-HEXYLPHENYL ESTER
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C24H23NO2
InChI InChI=1S/C24H23NO2/c1-2-3-4-5-6-18-8-13-23(14-9-18)27-24(26)22-12-11-20-15-19(17-25)7-10-21(20)16-22/h7-16H,2-6H2,1H3
InChIKey QYKIOSWQBXNQKF-UHFFFAOYSA-N
Molecular Weight 357.1723
SMILES c12cc(C#N)ccc2cc(C(Oc2ccc(CCCCCC)cc2)=O)cc1
SPLASH splash10-001i-4900000000-727c0d827024fd1dc0cb
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany