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4-[6-(4-chlorophenyl)-7-oxa-3-azabicyclo[4.1.0]heptan-3-yl]-1-(4-fluorophenyl)-1-butanone
SpectraBase Compound ID 5rnAePHSV73
InChI InChI=1S/C21H21ClFNO2/c22-17-7-5-16(6-8-17)21-11-13-24(14-20(21)26-21)12-1-2-19(25)15-3-9-18(23)10-4-15/h3-10,20H,1-2,11-14H2
InChIKey FCSBHQUBLPASQQ-UHFFFAOYSA-N
Mol Weight 373.86 g/mol
Molecular Formula C21H21ClFNO2
Exact Mass 373.124485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Psmq4yM0Of
Name 4-[6-(4-chlorophenyl)-7-oxa-3-azabicyclo[4.1.0]heptan-3-yl]-1-(4-fluorophenyl)-1-butanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21ClFNO2
InChI InChI=1S/C21H21ClFNO2/c22-17-7-5-16(6-8-17)21-11-13-24(14-20(21)26-21)12-1-2-19(25)15-3-9-18(23)10-4-15/h3-10,20H,1-2,11-14H2
InChIKey FCSBHQUBLPASQQ-UHFFFAOYSA-N
Molecular Weight 373.855 g/mol
SMILES C12(OC2CN(CC1)CCCC(c1ccc(cc1)F)=O)c1ccc(cc1)Cl
SPLASH splash10-0079-0091000000-3bdc6375512149d30ebd
Source of Spectrum C-118-5855-3
Synonyms 4-[6-(4-chlorophenyl)-7-oxa-3-azabicyclo[4.1.0]heptan-3-yl]-1-(4-fluorophenyl)butan-1-one
Wiley ID 759707