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6-Methoxy-5-methyl-3-phenyl-2H-benzo[h]chromen-2-one
SpectraBase Compound ID 1xy1AMbtK3m
InChI InChI=1S/C21H16O3/c1-13-17-12-18(14-8-4-3-5-9-14)21(22)24-20(17)16-11-7-6-10-15(16)19(13)23-2/h3-12H,1-2H3
InChIKey IMPUSPOPUGDPDI-UHFFFAOYSA-N
Mol Weight 316.36 g/mol
Molecular Formula C21H16O3
Exact Mass 316.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3ErDIGZ0gL
Name 6-Methoxy-5-methyl-3-phenyl-2H-benzo[h]chromen-2-one
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.109944372 u
Formula C21H16O3
InChI InChI=1S/C21H16O3/c1-13-17-12-18(14-8-4-3-5-9-14)21(22)24-20(17)16-11-7-6-10-15(16)19(13)23-2/h3-12H,1-2H3
InChIKey IMPUSPOPUGDPDI-UHFFFAOYSA-N
Instrument Name Micromass VG Quattro triple quadropole
Ionization Type EI
Literature Reference DOI 10.1002/anie.201805203
Molecular Weight 316.356 g/mol
Quality 100
Reported Formula C21H16O3
SMILES COC1=C(C2=C(C3=C1C=CC=C3)OC(C(=C2)C1=CC=CC=C1)=O)C
SPLASH splash10-014i-0937000000-a1a4f6b7340b88002f4e
Source of Spectrum ACI-57-SM9-1o (DOI: 10.1002/anie.201805203)
Wiley ID 1893109