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4H-1-benzopyran-3-carboxylic acid-2-n-propyl-ethyl ester
SpectraBase Compound ID 6fMVQCJSfXl
InChI InChI=1S/C15H18O3/c1-3-7-14-12(15(16)17-4-2)10-11-8-5-6-9-13(11)18-14/h5-6,8-9H,3-4,7,10H2,1-2H3
InChIKey HFLFGFDPVWIYPT-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3RfE52Fn0q
Name 4H-1-benzopyran-3-carboxylic acid-2-n-propyl-ethyl ester
Alternate Name(s) Ethyl 2-propyl-4H-chromene-3-carboxylate
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Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-3-7-14-12(15(16)17-4-2)10-11-8-5-6-9-13(11)18-14/h5-6,8-9H,3-4,7,10H2,1-2H3
InChIKey HFLFGFDPVWIYPT-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol200347g
Molecular Weight 246.306 g/mol
SMILES c1ccc2OC(=C(Cc2c1)C(OCC)=O)CCC
SPLASH splash10-0gi1-0690000000-a401c80d9a4055102374
Source of Spectrum A1-13-1972/SMS17-3h
Wiley ID 1753017