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4-(2,2-Diacetyl-2,3-dihydro-1H-benzo[b]cyclopenta[d]furan-1-yl)benzonitrile
SpectraBase Compound ID EP2OpL2WP7p
InChI InChI=1S/C22H17NO3/c1-13(24)22(14(2)25)11-19-20(17-5-3-4-6-18(17)26-19)21(22)16-9-7-15(12-23)8-10-16/h3-10,21H,11H2,1-2H3
InChIKey ZFSOFPCMSJJHQF-UHFFFAOYSA-N
Mol Weight 343.38 g/mol
Molecular Formula C22H17NO3
Exact Mass 343.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 31hU4G5jpwo
Name 4-(2,2-Diacetyl-2,3-dihydro-1H-benzo[b]cyclopenta[d]furan-1-yl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17NO3
InChI InChI=1S/C22H17NO3/c1-13(24)22(14(2)25)11-19-20(17-5-3-4-6-18(17)26-19)21(22)16-9-7-15(12-23)8-10-16/h3-10,21H,11H2,1-2H3
InChIKey ZFSOFPCMSJJHQF-UHFFFAOYSA-N
Molecular Weight 343.382 g/mol
SMILES c12ccccc2c2C(C(C(=O)C)(C(=O)C)Cc2o1)c1ccc(cc1)C#N
SPLASH splash10-0ufr-0069000000-dc37ef6bda5bf5482ccb
Source of Spectrum KD-52-3328/SM15-3eg
Synonyms 4-(2,2-diacetyl-2,3-dihydro-1H-cyclopenta[b]benzofuran-1-yl)benzonitrile
Wiley ID 1803818