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1-(4-Bromophenyl)-4,4,6-trimethyl-3,4-dihydro-2(1H)-pyrimidinethione
SpectraBase Compound ID HIjpiaegSok
InChI InChI=1S/C13H15BrN2S/c1-9-8-13(2,3)15-12(17)16(9)11-6-4-10(14)5-7-11/h4-8H,1-3H3,(H,15,17)
InChIKey XIFWGXVLXMTXKG-UHFFFAOYSA-N
Mol Weight 311.24 g/mol
Molecular Formula C13H15BrN2S
Exact Mass 310.013933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 97fwqUgFPH8
Name 1-(4-Bromophenyl)-4,4,6-trimethyl-3,4-dihydro-2(1H)-pyrimidinethione
CAS Registry Number 37489-47-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15BrN2S
InChI InChI=1S/C13H15BrN2S/c1-9-8-13(2,3)15-12(17)16(9)11-6-4-10(14)5-7-11/h4-8H,1-3H3,(H,15,17)
InChIKey XIFWGXVLXMTXKG-UHFFFAOYSA-N
Molecular Weight 311.241 g/mol
SMILES N1C(C=C(N(C1=S)c1ccc(cc1)Br)C)(C)C
SPLASH splash10-0002-9571000000-038619b204e1fff0088e
Source of Spectrum AD-0-2532-0
Synonyms 3-(4-bromophenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione Pyrimidine-2(1H)-thione, 3,4-dihydro-1-(4-bromophenyl)-4,4,6-trimethyl-
Wiley ID 1430419