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1-[2-phenyl-6-[(phenylmethyl)amino]-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone
SpectraBase Compound ID 7NDi0C7s6Ek
InChI InChI=1S/C19H17N3OS/c1-13(23)16-18(20-12-14-8-4-2-5-9-14)21-17(22-19(16)24)15-10-6-3-7-11-15/h2-11H,12H2,1H3,(H2,20,21,22,24)
InChIKey ZXFBXDAZAVNXJJ-UHFFFAOYSA-N
Mol Weight 335.43 g/mol
Molecular Formula C19H17N3OS
Exact Mass 335.109233 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HqV0rXwPYcX
Name 1-[2-phenyl-6-[(phenylmethyl)amino]-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone
Alternate Name(s) 1-[6-(benzylamino)-2-phenyl-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone 1-[6-(benzylamino)-2-phenyl-4-thioxo-1H-pyrimidin-5-yl]ethanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17N3OS
InChI InChI=1S/C19H17N3OS/c1-13(23)16-18(20-12-14-8-4-2-5-9-14)21-17(22-19(16)24)15-10-6-3-7-11-15/h2-11H,12H2,1H3,(H2,20,21,22,24)
InChIKey ZXFBXDAZAVNXJJ-UHFFFAOYSA-N
Molecular Weight 335.425 g/mol
SMILES N1C(=NC(=C(C1=S)C(=O)C)NCc1ccccc1)c1ccccc1
SPLASH splash10-0006-0092000000-e439b282d36dc31c3139
Source of Spectrum F9-1993-1936-4
Wiley ID 1566827