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3-(2,5-dimethyl-7-oxo-3-phenylazo-6H-pyrazolo[1,5-a]pyrimidin-6-yl)pentane-2,4-dione
SpectraBase Compound ID 9UyDqUKHYs9
InChI InChI=1S/C19H19N5O3/c1-10-15(16(12(3)25)13(4)26)19(27)24-18(20-10)17(11(2)23-24)22-21-14-8-6-5-7-9-14/h5-9,15-16H,1-4H3
InChIKey NSYWERBCUDLNTC-UHFFFAOYSA-N
Mol Weight 365.39 g/mol
Molecular Formula C19H19N5O3
Exact Mass 365.148789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID hQZF0Wgd6
Name 3-(2,5-dimethyl-7-oxo-3-phenylazo-6H-pyrazolo[1,5-a]pyrimidin-6-yl)pentane-2,4-dione
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19N5O3
InChI InChI=1S/C19H19N5O3/c1-10-15(16(12(3)25)13(4)26)19(27)24-18(20-10)17(11(2)23-24)22-21-14-8-6-5-7-9-14/h5-9,15-16H,1-4H3
InChIKey NSYWERBCUDLNTC-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-Q1000-EX or GCMS 5988-A HP
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.a16
Molecular Weight 365.393 g/mol
SMILES C1([n]2c(N=C(C1C(C(C)=O)C(=O)C)C)c(N=Nc1ccccc1)c(C)n2)=O
SPLASH splash10-0a4l-2930000000-24db48b8481b6fb850f6
Source of Spectrum ARK-2009-171-5b
Wiley ID 1869634