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4-(4-Fluorophenyl)isocoumarin
SpectraBase Compound ID LR0lD4ptTA3
InChI InChI=1S/C15H9FO2/c16-11-7-5-10(6-8-11)14-9-18-15(17)13-4-2-1-3-12(13)14/h1-9H
InChIKey ZRXHTNAUKUQCQC-UHFFFAOYSA-N
Mol Weight 240.23 g/mol
Molecular Formula C15H9FO2
Exact Mass 240.058658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kk4cQ4DVFGH
Name 4-(4-Fluorophenyl)isocoumarin
Alternate Name(s) 4-(4-fluorophenyl)-1H-2-benzopyran-1-one
CAS Registry Number 92608-97-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H9FO2
InChI InChI=1S/C15H9FO2/c16-11-7-5-10(6-8-11)14-9-18-15(17)13-4-2-1-3-12(13)14/h1-9H
InChIKey ZRXHTNAUKUQCQC-UHFFFAOYSA-N
Molecular Weight 240.233 g/mol
SMILES C=1(c2c(cccc2)C(OC1)=O)c1ccc(cc1)F
SPLASH splash10-01qc-1590000000-b729ea9ab292e61ac6bb
Source of Spectrum W5-1989-35632-29904
Wiley ID 1243195