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Methyl 1-(4-cyanophenyl)-2-methyl-2,3-dihydro-1H-benzo[b]cyclopenta[d]furan-2-carboxylate
SpectraBase Compound ID JxCi4iNlWnf
InChI InChI=1S/C21H17NO3/c1-21(20(23)24-2)11-17-18(15-5-3-4-6-16(15)25-17)19(21)14-9-7-13(12-22)8-10-14/h3-10,19H,11H2,1-2H3
InChIKey UUVHRYXEEXFRDX-UHFFFAOYSA-N
Mol Weight 331.37 g/mol
Molecular Formula C21H17NO3
Exact Mass 331.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JpyJqzsly8i
Name Methyl 1-(4-cyanophenyl)-2-methyl-2,3-dihydro-1H-benzo[b]cyclopenta[d]furan-2-carboxylate
Alternate Name(s) Methyl 1-(4-cyanophenyl)-2-methyl-2,3-dihydro-1H-cyclopenta[b]benzofuran-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17NO3
InChI InChI=1S/C21H17NO3/c1-21(20(23)24-2)11-17-18(15-5-3-4-6-16(15)25-17)19(21)14-9-7-13(12-22)8-10-14/h3-10,19H,11H2,1-2H3
InChIKey UUVHRYXEEXFRDX-UHFFFAOYSA-N
Molecular Weight 331.371 g/mol
SMILES c12oc3c(c2cccc1)C(C(C3)(C(=O)OC)C)c1ccc(cc1)C#N
SPLASH splash10-00e9-0095000000-47fdee8f8f74701b2e98
Source of Spectrum KD-52-3328/SM13-3ea
Wiley ID 1803817