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5-(5-(4-(Diethylamino)phenyl)thiophen-2-yl)-9-hydroxy-1H-phenalen-1-one
SpectraBase Compound ID B4p5PYrhTQS
InChI InChI=1S/C27H23NO2S/c1-3-28(4-2)21-9-5-17(6-10-21)24-13-14-25(31-24)20-15-18-7-11-22(29)27-23(30)12-8-19(16-20)26(18)27/h5-16,29H,3-4H2,1-2H3
InChIKey KSTLJNJXWSXGAP-UHFFFAOYSA-N
Mol Weight 425.55 g/mol
Molecular Formula C27H23NO2S
Exact Mass 425.14495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DvQcNNFfvBN
Name 5-(5-(4-(Diethylamino)phenyl)thiophen-2-yl)-9-hydroxy-1H-phenalen-1-one
Appearance Dark violet solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 425.144950157 u
Formula C27H23NO2S
InChI InChI=1S/C27H23NO2S/c1-3-28(4-2)21-9-5-17(6-10-21)24-13-14-25(31-24)20-15-18-7-11-22(29)27-23(30)12-8-19(16-20)26(18)27/h5-16,29H,3-4H2,1-2H3
InChIKey KSTLJNJXWSXGAP-UHFFFAOYSA-N
Instrument Name Finnigan TSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201700553
Molecular Weight 425.546 g/mol
Quality 64
SMILES OC=1C=CC=2C3=C(C=C(C4=CC=C(C5=CC=C(N(CC)CC)C=C5)S4)C2)C=CC(C13)=O
SPLASH splash10-01u0-0103900000-ed8d9ce01bc4b693fa38
Source of Spectrum QE-23-SM12-3n (DOI: 10.1002/chem.201700553)
Wiley ID 1905634