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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 IfmNsmxszIc
Name 6-Cyano-naphthalene-2-carboxylic acid, 4-hexyl-phenyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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 357.453 g/mol
SMILES C(CCCCc1ccc(OC(c2ccc3c(c2)ccc(c3)C#N)=O)cc1)C
SPLASH splash10-001i-4900000000-cba27b2481db400eaab3
Synonyms (4-hexylphenyl) 6-cyanonaphthalene-2-carboxylate 4-Hexylphenyl 6-cyano-2-naphthoate 6-cyano-2-naphthalenecarboxylic acid (4-hexylphenyl) ester
Wiley ID 1485548