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5-bromo-3-(4-chlorophenyl)-7-methylisobenzofuran-1(3H)-one
SpectraBase Compound ID 72AWxo2Mvl6
InChI InChI=1S/C15H10BrClO2/c1-8-6-10(16)7-12-13(8)15(18)19-14(12)9-2-4-11(17)5-3-9/h2-7,14H,1H3
InChIKey QXENZYFXNVSIHC-UHFFFAOYSA-N
Mol Weight 337.6 g/mol
Molecular Formula C15H10BrClO2
Exact Mass 335.95527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ICcVRRfDDWK
Name 5-bromo-3-(4-chlorophenyl)-7-methylisobenzofuran-1(3H)-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H10BrClO2
InChI InChI=1S/C15H10BrClO2/c1-8-6-10(16)7-12-13(8)15(18)19-14(12)9-2-4-11(17)5-3-9/h2-7,14H,1H3
InChIKey QXENZYFXNVSIHC-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1002/anie.201812742
Molecular Weight 337.600 g/mol
Reported Formula C15H10(79)BrClO2
SMILES c12c(c(cc(c2)Br)C)C(OC1c1ccc(cc1)Cl)=O
SPLASH splash10-0002-0902000000-531861d358a57e62752b
Source of Spectrum ACI-58-SM65-17e
Wiley ID 1840638