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4-Octylphenyl 6-cyano-2-naphthoate

View entire compound with spectra: 2 MS (GC)

4-Octylphenyl 6-cyano-2-naphthoate
SpectraBase Compound ID 8GQMnxzk0mX
InChI InChI=1S/C26H27NO2/c1-2-3-4-5-6-7-8-20-10-15-25(16-11-20)29-26(28)24-14-13-22-17-21(19-27)9-12-23(22)18-24/h9-18H,2-8H2,1H3
InChIKey OCRLIITXDFLKRX-UHFFFAOYSA-N
Mol Weight 385.51 g/mol
Molecular Formula C26H27NO2
Exact Mass 385.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KrO7HsscAWK
Name 4-Octylphenyl 6-cyano-2-naphthoate
Alternate Name(s) (4-octylphenyl) 6-cyanonaphthalene-2-carboxylate 6-cyano-2-naphthalenecarboxylic acid (4-octylphenyl) ester 6-cyanonaphthalene-2-carboxylic acid (4-octylphenyl) ester
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Formula C26H27NO2
InChI InChI=1S/C26H27NO2/c1-2-3-4-5-6-7-8-20-10-15-25(16-11-20)29-26(28)24-14-13-22-17-21(19-27)9-12-23(22)18-24/h9-18H,2-8H2,1H3
InChIKey OCRLIITXDFLKRX-UHFFFAOYSA-N
Molecular Weight 385.507 g/mol
SMILES c1c(ccc(OC(c2ccc3cc(ccc3c2)C#N)=O)c1)CCCCCCCC
SPLASH splash10-001i-1900000000-3bb566f6f6cb1a89d430
Wiley ID 1487687