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2-Benzoyl-3-(4-isopropylphenyl)-4H-thieno[3,2-c]chromen-4-one
SpectraBase Compound ID 8cyCo4B6IQJ
InChI InChI=1S/C27H20O3S/c1-16(2)17-12-14-18(15-13-17)22-23-25(20-10-6-7-11-21(20)30-27(23)29)31-26(22)24(28)19-8-4-3-5-9-19/h3-16H,1-2H3
InChIKey DNXKMLKMTDWOOQ-UHFFFAOYSA-N
Mol Weight 424.51 g/mol
Molecular Formula C27H20O3S
Exact Mass 424.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOR7n0yrC9N
Name 2-Benzoyl-3-(4-isopropylphenyl)-4H-thieno[3,2-c]chromen-4-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.113315675 u
Formula C27H20O3S
InChI InChI=1S/C27H20O3S/c1-16(2)17-12-14-18(15-13-17)22-23-25(20-10-6-7-11-21(20)30-27(23)29)31-26(22)24(28)19-8-4-3-5-9-19/h3-16H,1-2H3
InChIKey DNXKMLKMTDWOOQ-UHFFFAOYSA-N
Instrument Name Agilent HP 5973
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800361
Molecular Weight 424.514 g/mol
Quality 299
SMILES C1=2SC(=C(C2C(OC2=C1C=CC=C2)=O)C1=CC=C(C=C1)C(C)C)C(C1=CC=CC=C1)=O
SPLASH splash10-0ae9-4528900000-9231854b6f093acb49cd
Source of Spectrum K1-2018-3014-4abd (DOI: 10.1002/ejoc.201800361)
Wiley ID 1891728