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2-Propanone, 1-(pyrido[3,4-d]pyridazin-8-ylthio)-
SpectraBase Compound ID CNlRCjPEt4B
InChI InChI=1S/C10H9N3OS/c1-7(14)6-15-10-9-8(5-12-13-10)3-2-4-11-9/h2-5H,6H2,1H3
InChIKey ZJGNRBYHWZYAAP-UHFFFAOYSA-N
Mol Weight 219.26 g/mol
Molecular Formula C10H9N3OS
Exact Mass 219.046633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HhWD1DV8JV
Name 2-Propanone, 1-(pyrido[3,4-d]pyridazin-8-ylthio)-
CAS Registry Number 18599-29-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9N3OS
InChI InChI=1S/C10H9N3OS/c1-7(14)6-15-10-9-8(5-12-13-10)3-2-4-11-9/h2-5H,6H2,1H3
InChIKey ZJGNRBYHWZYAAP-UHFFFAOYSA-N
Molecular Weight 219.262 g/mol
SMILES CC(CSc1c2c(cccn2)cnn1)=O
SPLASH splash10-0059-7910000000-9a7742bc33e6dd6beec8
Source of Spectrum O-8-39-7
Synonyms 1-(Pyrido[2,3-d]pyridazin-8-ylsulfanyl)acetone 1-(8-pyrido[2,3-d]pyridazinylthio)-2-propanone 1-(pyrido[2,3-d]pyridazin-8-ylthio)acetone 1-Pyrido[2,3-d]pyridazin-8-ylsulfanylpropan-2-one
Wiley ID 1218659