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5-Amino-3-methyl-1-phenyl-1Hthieno[3,2-e]pyrazolo[3,4-b]pyrazine-6-carboxylic acid
SpectraBase Compound ID 4ulxKZXVLt4
InChI InChI=1S/C15H11N5O2S/c1-7-10-13(20(19-7)8-5-3-2-4-6-8)18-14-11(17-10)9(16)12(23-14)15(21)22/h2-6H,16H2,1H3,(H,21,22)
InChIKey JWDRPNSXZRVRLV-UHFFFAOYSA-N
Mol Weight 325.35 g/mol
Molecular Formula C15H11N5O2S
Exact Mass 325.063346 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hkSUWFRsen
Name 5-Amino-3-methyl-1-phenyl-1Hthieno[3,2-e]pyrazolo[3,4-b]pyrazine-6-carboxylic acid
Appearance Red powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11N5O2S
InChI InChI=1S/C15H11N5O2S/c1-7-10-13(20(19-7)8-5-3-2-4-6-8)18-14-11(17-10)9(16)12(23-14)15(21)22/h2-6H,16H2,1H3,(H,21,22)
InChIKey JWDRPNSXZRVRLV-UHFFFAOYSA-N
Instrument Name Jeol-JMS 600
Ionization Type EI
Literature Reference DOI 10.1002/jccs.201900056
Molecular Weight 325.346 g/mol
SMILES Nc1c(C(=O)O)sc2nc3c(nc12)c(n[n]3-c1ccccc1)C
SPLASH splash10-003r-1179000000-9d0e74ba451602305431
Source of Spectrum QA-67-SM35-15
Wiley ID 1840130