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5-Acetyl-3-phenyl-1,2,3,4-tetrahydropyrimidin-2-thione

View entire compound with spectra: 1 MS (GC)

5-Acetyl-3-phenyl-1,2,3,4-tetrahydropyrimidin-2-thione
SpectraBase Compound ID 3ZXPUjXvyfe
InChI InChI=1S/C12H12N2OS/c1-9(15)10-7-13-12(16)14(8-10)11-5-3-2-4-6-11/h2-7H,8H2,1H3,(H,13,16)
InChIKey APPSHDGXEHYPRD-UHFFFAOYSA-N
Mol Weight 232.3 g/mol
Molecular Formula C12H12N2OS
Exact Mass 232.067034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FXBQYOCnj8h
Name 5-Acetyl-3-phenyl-1,2,3,4-tetrahydropyrimidin-2-thione
Alternate Name(s) 1-(3-phenyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2OS
InChI InChI=1S/C12H12N2OS/c1-9(15)10-7-13-12(16)14(8-10)11-5-3-2-4-6-11/h2-7H,8H2,1H3,(H,13,16)
InChIKey APPSHDGXEHYPRD-UHFFFAOYSA-N
Molecular Weight 232.301 g/mol
SMILES N1C=C(CN(C1=S)c1ccccc1)C(=O)C
SPLASH splash10-001i-5490000000-b49444c0ac57474c4ca4
Source of Spectrum SO-0-700-10
Wiley ID 877646