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3-ALLYL-2-THIOURACIL
SpectraBase Compound ID Hcvz6NNBWJS
InChI InChI=1S/C7H8N2OS/c1-2-5-9-6(10)3-4-8-7(9)11/h2-4H,1,5H2,(H,8,11)
InChIKey ZIIVZWHGRBKRJZ-UHFFFAOYSA-N
Mol Weight 168.21 g/mol
Molecular Formula C7H8N2OS
Exact Mass 168.035734 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SWAP63QAYO
Name 3-allyl-2-thioxo-1H-pyrimidin-4-one
Alternate Name(s) 3-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8N2OS
InChI InChI=1S/C7H8N2OS/c1-2-5-9-6(10)3-4-8-7(9)11/h2-4H,1,5H2,(H,8,11)
InChIKey ZIIVZWHGRBKRJZ-UHFFFAOYSA-N
Molecular Weight 168.214 g/mol
SMILES N1C=CC(N(C1=S)CC=C)=O
SPLASH splash10-0udi-0900000000-6e14736481f4da265dc3
Source of Spectrum E2-46-1373-19
Wiley ID 1554605