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5-Amino-3-methyl-1-phenyl-1H-thieno[3,2-e]pyrazolo[3,4-b]pyrazine-6-carbonyl oxyacetone
SpectraBase Compound ID 3sZZ08LwbBp
InChI InChI=1S/C18H15N5O3S/c1-9(24)8-26-18(25)15-12(19)14-17(27-15)21-16-13(20-14)10(2)22-23(16)11-6-4-3-5-7-11/h3-7H,8,19H2,1-2H3
InChIKey FVPHLLBADPZQLL-UHFFFAOYSA-N
Mol Weight 381.41 g/mol
Molecular Formula C18H15N5O3S
Exact Mass 381.089561 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2TM863hwgvD
Name 5-Amino-3-methyl-1-phenyl-1H-thieno[3,2-e]pyrazolo[3,4-b]pyrazine-6-carbonyl oxyacetone
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15N5O3S
InChI InChI=1S/C18H15N5O3S/c1-9(24)8-26-18(25)15-12(19)14-17(27-15)21-16-13(20-14)10(2)22-23(16)11-6-4-3-5-7-11/h3-7H,8,19H2,1-2H3
InChIKey FVPHLLBADPZQLL-UHFFFAOYSA-N
Instrument Name Shimadzu Qp-2010 plus
Ionization Type EI
Literature Reference DOI 10.1002/jccs.201900056
Molecular Weight 381.410 g/mol
SMILES Nc1c2nc3c(nc2sc1C(=O)OCC(C)=O)[n](nc3C)-c1ccccc1
SPLASH splash10-053r-5229000000-cd47d754b24dd80ea46d
Source of Spectrum QA-67-SM44-21a
Wiley ID 1840133