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benzo[d][1,3]dioxol-5-yl(4-chlorophenyl)methanone
SpectraBase Compound ID HOAuX6Qn4oe
InChI InChI=1S/C14H9ClO3/c15-11-4-1-9(2-5-11)14(16)10-3-6-12-13(7-10)18-8-17-12/h1-7H,8H2
InChIKey RLBFWLQJDHOFNP-UHFFFAOYSA-N
Mol Weight 260.68 g/mol
Molecular Formula C14H9ClO3
Exact Mass 260.024022 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GEzmhYHCDR
Name benzo[d][1,3]dioxol-5-yl(4-chlorophenyl)methanone
Appearance White solid
Carrier Gas Nitrogen
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Exact Mass 260.024021847 u
Formula C14H9ClO3
InChI InChI=1S/C14H9ClO3/c15-11-4-1-9(2-5-11)14(16)10-3-6-12-13(7-10)18-8-17-12/h1-7H,8H2
InChIKey RLBFWLQJDHOFNP-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201709553
Quality 99
Reported Formula C14H9ClO3
SMILES C1=CC(=CC=2OCOC12)C(=O)C1=CC=C(C=C1)Cl
SPLASH splash10-01ot-0950000000-f67b9bba28d4d06e0982
Source of Spectrum ACI-56-SM41-21a (DOI: 10.1002/anie.201709553)
Thin-Layer Chromatography 0.31 (SiO2, i-hexane/EtOAc, 95:5)
Wiley ID 1896751