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3-Benzyl-1,2,3,4-tetrahydro-2,4-dioxo-1-phenylquinolin-3-yl Thiocyanate
SpectraBase Compound ID KZ7ST2sgct6
InChI InChI=1S/C23H16N2O2S/c24-16-28-23(15-17-9-3-1-4-10-17)21(26)19-13-7-8-14-20(19)25(22(23)27)18-11-5-2-6-12-18/h1-14H,15H2
InChIKey IIHAJKYCTSUBOM-UHFFFAOYSA-N
Mol Weight 384.45 g/mol
Molecular Formula C23H16N2O2S
Exact Mass 384.093249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G3BoqCma1u4
Name 3-Benzyl-1,2,3,4-tetrahydro-2,4-dioxo-1-phenylquinolin-3-yl Thiocyanate
Alternate Name(s) 3-Benzyl-1-phenyl-3-thiocyanatoquinoline-2,4(1H,3H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H16N2O2S
InChI InChI=1S/C23H16N2O2S/c24-16-28-23(15-17-9-3-1-4-10-17)21(26)19-13-7-8-14-20(19)25(22(23)27)18-11-5-2-6-12-18/h1-14H,15H2
InChIKey IIHAJKYCTSUBOM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201200049
Molecular Weight 384.453 g/mol
SMILES C1(N(c2ccccc2C(C1(Cc1ccccc1)SC#N)=O)c1ccccc1)=O
SPLASH splash10-0ab9-9201000000-3e8875c767f13deab2d3
Source of Spectrum H-95-1364-2l
Wiley ID 1784438