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2-Methyl-7-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
SpectraBase Compound ID I2OcYnz7yqB
InChI InChI=1S/C12H9N3OS/c1-8-14-15-11(16)7-10(13-12(15)17-8)9-5-3-2-4-6-9/h2-7H,1H3
InChIKey NQWOQIXDRWODSL-UHFFFAOYSA-N
Mol Weight 243.28 g/mol
Molecular Formula C12H9N3OS
Exact Mass 243.046633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7I6GqOCP1fU
Name 2-Methyl-7-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
CAS Registry Number 42484-76-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9N3OS
InChI InChI=1S/C12H9N3OS/c1-8-14-15-11(16)7-10(13-12(15)17-8)9-5-3-2-4-6-9/h2-7H,1H3
InChIKey NQWOQIXDRWODSL-UHFFFAOYSA-N
Molecular Weight 243.284 g/mol
SMILES CC1=NN2C(C=C(c3ccccc3)N=C2S1)=O
SPLASH splash10-0006-9560000000-783f49042ada2ab89f1c
Source of Spectrum W5-1989-37959-27577
Wiley ID 1245919