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2-[(Cyclohexylideneamino)thio]-6-phenylpyrimidin-4-one
SpectraBase Compound ID CF5KpCQNY7t
InChI InChI=1S/C16H17N3OS/c20-15-11-14(12-7-3-1-4-8-12)17-16(18-15)21-19-13-9-5-2-6-10-13/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,17,18,20)
InChIKey ISASMBPKEWGZRR-UHFFFAOYSA-N
Mol Weight 299.39 g/mol
Molecular Formula C16H17N3OS
Exact Mass 299.109233 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YbNYiWUzTB
Name 2-[(Cyclohexylideneamino)thio]-6-phenylpyrimidin-4-one
Alternate Name(s) 2-[(cyclohexylideneamino)sulfanyl]-6-phenyl-4(3H)-pyrimidinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N3OS
InChI InChI=1S/C16H17N3OS/c20-15-11-14(12-7-3-1-4-8-12)17-16(18-15)21-19-13-9-5-2-6-10-13/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,17,18,20)
InChIKey ISASMBPKEWGZRR-UHFFFAOYSA-N
Molecular Weight 299.392 g/mol
SMILES N1C(C=C(N=C1SN=C1CCCCC1)c1ccccc1)=O
SPLASH splash10-0l02-2590000000-4b42b3c904cb8ea72a7f
Source of Spectrum U-1994-180-11
Wiley ID 765694