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2-[(4-Hydroxy-6-methyl-2,5-dioxo-5,6-dihydro-2H-pyrano[3,2-c]quinolin-3-yl)methylidene]-N-phenylhydrazinecarbothioamide
SpectraBase Compound ID DYUDCYhe0Ay
InChI InChI=1S/C21H16N4O4S/c1-25-15-10-6-5-9-13(15)18-16(19(25)27)17(26)14(20(28)29-18)11-22-24-21(30)23-12-7-3-2-4-8-12/h2-11,26H,1H3,(H2,23,24,30)
InChIKey NRMRRPXHGZUGNG-UHFFFAOYSA-N
Mol Weight 420.44 g/mol
Molecular Formula C21H16N4O4S
Exact Mass 420.089226 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GCoQS6roRX3
Name 2-[(4-Hydroxy-6-methyl-2,5-dioxo-5,6-dihydro-2H-pyrano[3,2-c]quinolin-3-yl)methylidene]-N-phenylhydrazinecarbothioamide
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N4O4S
InChI InChI=1S/C21H16N4O4S/c1-25-15-10-6-5-9-13(15)18-16(19(25)27)17(26)14(20(28)29-18)11-22-24-21(30)23-12-7-3-2-4-8-12/h2-11,26H,1H3,(H2,23,24,30)
InChIKey NRMRRPXHGZUGNG-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3353
Molecular Weight 420.443 g/mol
SMILES OC1=C(C=NNC(=S)Nc2ccccc2)C(OC2=C1C(N(c1c2cccc1)C)=O)=O
SPLASH splash10-014i-2190000000-80acaf7ae36ef616d846
Source of Spectrum Y-55-2841-16
Wiley ID 1878956