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2-Benzoyl-3-(4-methylphenyl)-4H-thieno[3,2-c]chromen-4-one
SpectraBase Compound ID 6XYzccQcq6c
InChI InChI=1S/C25H16O3S/c1-15-11-13-16(14-12-15)20-21-23(18-9-5-6-10-19(18)28-25(21)27)29-24(20)22(26)17-7-3-2-4-8-17/h2-14H,1H3
InChIKey PCWRLPFPOMYPDE-UHFFFAOYSA-N
Mol Weight 396.46 g/mol
Molecular Formula C25H16O3S
Exact Mass 396.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fqk1ew0ZzN
Name 2-Benzoyl-3-(4-methylphenyl)-4H-thieno[3,2-c]chromen-4-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.082015546 u
Formula C25H16O3S
InChI InChI=1S/C25H16O3S/c1-15-11-13-16(14-12-15)20-21-23(18-9-5-6-10-19(18)28-25(21)27)29-24(20)22(26)17-7-3-2-4-8-17/h2-14H,1H3
InChIKey PCWRLPFPOMYPDE-UHFFFAOYSA-N
Instrument Name Agilent HP 5973
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800361
Molecular Weight 396.460 g/mol
Quality 429
SMILES C1=2SC(=C(C2C(OC2=C1C=CC=C2)=O)C1=CC=C(C=C1)C)C(C1=CC=CC=C1)=O
SPLASH splash10-001j-2119000000-4034fff50a07c5788b1c
Source of Spectrum K1-2018-3013-4abc (DOI: 10.1002/ejoc.201800361)
Wiley ID 1891727