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4-(4-Bromophenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-2-thioxo-tetrahydropyrimidin-5(6H)-one
SpectraBase Compound ID 28g4ybMxka5
InChI InChI=1S/C20H19BrN2OS/c21-16-9-7-13(8-10-16)17-19(24)18(23-20(25)22-17)15-6-5-12-3-1-2-4-14(12)11-15/h5-11,17-18H,1-4H2,(H2,22,23,25)
InChIKey NSMOCVQBVHYFNN-UHFFFAOYSA-N
Mol Weight 415.35 g/mol
Molecular Formula C20H19BrN2OS
Exact Mass 414.040147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4GRnsvdvBUd
Name 4-(4-Bromophenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-2-thioxo-tetrahydropyrimidin-5(6H)-one
Alternate Name(s) 4-(4-bromophenyl)-2-sulfanylidene-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-diazinan-5-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19BrN2OS
InChI InChI=1S/C20H19BrN2OS/c21-16-9-7-13(8-10-16)17-19(24)18(23-20(25)22-17)15-6-5-12-3-1-2-4-14(12)11-15/h5-11,17-18H,1-4H2,(H2,22,23,25)
InChIKey NSMOCVQBVHYFNN-UHFFFAOYSA-N
Molecular Weight 415.349 g/mol
SMILES N1C(NC(C(C1c1cc2CCCCc2cc1)=O)c1ccc(cc1)Br)=S
SPLASH splash10-001i-0090300000-3218d42c03dc13316cb4
Source of Spectrum F2-45-1499-6c
Wiley ID 1689115