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3-[(2,5-Dimethyl-1-benzofuran-3-yl)carbonyl]-4-methoxybenzonitrile
SpectraBase Compound ID 9EHdnK6Dr1c
InChI InChI=1S/C19H15NO3/c1-11-4-6-17-14(8-11)18(12(2)23-17)19(21)15-9-13(10-20)5-7-16(15)22-3/h4-9H,1-3H3
InChIKey CRXHVRMHQWMBAT-UHFFFAOYSA-N
Mol Weight 305.33 g/mol
Molecular Formula C19H15NO3
Exact Mass 305.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GATYqohQ6W
Name 3-[(2,5-Dimethyl-1-benzofuran-3-yl)carbonyl]-4-methoxybenzonitrile
Alternate Name(s) 3-(2,5-dimethylbenzofuran-3-carbonyl)-4-methoxybenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15NO3
InChI InChI=1S/C19H15NO3/c1-11-4-6-17-14(8-11)18(12(2)23-17)19(21)15-9-13(10-20)5-7-16(15)22-3/h4-9H,1-3H3
InChIKey CRXHVRMHQWMBAT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cbdv.201200275
Molecular Weight 305.333 g/mol
SMILES C(c1cc(c(cc1)OC)C(=O)c1c(oc2c1cc(cc2)C)C)#N
SPLASH splash10-0c00-0925000000-e8d34169fd241e9464ff
Source of Spectrum CBD-9-2629-8i
Wiley ID 1771085