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2-(2-Heptylphenyl)-2,3-dihydrobenzopyran-6-carboxylic Acid
SpectraBase Compound ID K2PuaALOAEg
InChI InChI=1S/C23H28O3/c1-2-3-4-5-6-9-17-10-7-8-11-20(17)22-15-12-18-16-19(23(24)25)13-14-21(18)26-22/h7-8,10-11,13-14,16,22H,2-6,9,12,15H2,1H3,(H,24,25)
InChIKey SCHSWWMLGKGCPB-UHFFFAOYSA-N
Mol Weight 352.47 g/mol
Molecular Formula C23H28O3
Exact Mass 352.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID qWaWUrLpQ
Name 2-(2-Heptylphenyl)-2,3-dihydrobenzopyran-6-carboxylic Acid
Alternate Name(s) 2-(2-heptylphenyl)-6-chromanecarboxylic acid
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Formula C23H28O3
InChI InChI=1S/C23H28O3/c1-2-3-4-5-6-9-17-10-7-8-11-20(17)22-15-12-18-16-19(23(24)25)13-14-21(18)26-22/h7-8,10-11,13-14,16,22H,2-6,9,12,15H2,1H3,(H,24,25)
InChIKey SCHSWWMLGKGCPB-UHFFFAOYSA-N
Molecular Weight 352.474 g/mol
SMILES OC(c1ccc2OC(c3c(CCCCCCC)cccc3)CCc2c1)=O
SPLASH splash10-0udi-0089000000-3f0e17e313d09b139c81
Source of Spectrum J-59-5934-6
Wiley ID 1343654