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5-(4-Fluorophenyl)benzo[d][1,3]dioxole
SpectraBase Compound ID IRiYXLcd1YG
InChI InChI=1S/C13H9FO2/c14-11-4-1-9(2-5-11)10-3-6-12-13(7-10)16-8-15-12/h1-7H,8H2
InChIKey DKIDGJHTFGNLNR-UHFFFAOYSA-N
Mol Weight 216.21 g/mol
Molecular Formula C13H9FO2
Exact Mass 216.058658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5CvhNfA5iAY
Name 5-(4-Fluorophenyl)benzo[d][1,3]dioxole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 216.058657691 u
Formula C13H9FO2
InChI InChI=1S/C13H9FO2/c14-11-4-1-9(2-5-11)10-3-6-12-13(7-10)16-8-15-12/h1-7H,8H2
InChIKey DKIDGJHTFGNLNR-UHFFFAOYSA-N
Instrument Name HP 5989B
Ionization Type EI
Literature Reference DOI 10.1002/chem.201600420
Molecular Weight 216.211 g/mol
Quality 101
SMILES C12=C(C=C(C3=CC=C(F)C=C3)C=C1)OCO2
SPLASH splash10-014i-0490000000-6844438378790b0897b2
Source of Spectrum QE-22-SM11-Table 4, entry 14 (DOI: 10.1002/chem.201600420)
Thin-Layer Chromatography 0.50 (Ethyl acetate/Hexane, 1:9)
Wiley ID 1903224