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4,5-Benzo-endo-7-benzoyl-1-isobutyryl-3-oxa-cis-bicyclo[4.1.0]hept-4-en-2-one
SpectraBase Compound ID 3eoO9WwykXk
InChI InChI=1S/C21H18O4/c1-12(2)19(23)21-16(14-10-6-7-11-15(14)25-20(21)24)17(21)18(22)13-8-4-3-5-9-13/h3-12,16-17H,1-2H3
InChIKey OJOPWUUKSCXVOU-UHFFFAOYSA-N
Mol Weight 334.37 g/mol
Molecular Formula C21H18O4
Exact Mass 334.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvFy0XGr3WZ
Name 4,5-Benzo-endo-7-benzoyl-1-isobutyryl-3-oxa-cis-bicyclo[4.1.0]hept-4-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18O4
InChI InChI=1S/C21H18O4/c1-12(2)19(23)21-16(14-10-6-7-11-15(14)25-20(21)24)17(21)18(22)13-8-4-3-5-9-13/h3-12,16-17H,1-2H3
InChIKey OJOPWUUKSCXVOU-UHFFFAOYSA-N
Molecular Weight 334.371 g/mol
SMILES C12(C(c3ccccc3OC2=O)C1C(=O)c1ccccc1)C(=O)C(C)C
SPLASH splash10-0bt9-0950000000-5ebbe3d0bb237f7889b8
Source of Spectrum F-49-2283-2
Synonyms 4,5-Benzo-exo-7-benzoyl-1-isobutyryl-3-oxa-cis-bicyclo[4.1.0]hept-4-en-2-one 1-Benzoyl-1a-isobutyryl-1a,7b-dihydrocyclopropa[c]chromen-2(1H)-one
Wiley ID 1331215