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5-Phenyl-1,3-benzodioxole
SpectraBase Compound ID Le9at9IU8wI
InChI InChI=1S/C13H10O2/c1-2-4-10(5-3-1)11-6-7-12-13(8-11)15-9-14-12/h1-8H,9H2
InChIKey UXRKFHHUQLJTPC-UHFFFAOYSA-N
Mol Weight 198.22 g/mol
Molecular Formula C13H10O2
Exact Mass 198.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ka8DGQ2Stq5
Name 5-Phenylbenzo[d][1,3]dioxole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O2
InChI InChI=1S/C13H10O2/c1-2-4-10(5-3-1)11-6-7-12-13(8-11)15-9-14-12/h1-8H,9H2
InChIKey UXRKFHHUQLJTPC-UHFFFAOYSA-N
Instrument Name HP 5989B
Ionization Type EI
Literature Reference DOI 10.1002/chem.201600420
Molecular Weight 198.221 g/mol
Quality 164
SMILES C12=CC=C(C=C2OCO1)C1=CC=CC=C1
SPLASH splash10-0002-0900000000-c36eb8852e8dbe82c148
Source of Spectrum QE-22-SM10-Table 4, entry 8 (DOI: 10.1002/chem.201600420)
Thin-Layer Chromatography 0.40 (Ethyl acetate/Hexane, 1:9)
Wiley ID 1903242