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5-Benzylidene-3-pentyl-2-thioxoimidazolidin-4-one
SpectraBase Compound ID Df80kDMM0lB
InChI InChI=1S/C15H18N2OS/c1-2-3-7-10-17-14(18)13(16-15(17)19)11-12-8-5-4-6-9-12/h4-6,8-9,11H,2-3,7,10H2,1H3,(H,16,19)/b13-11-
InChIKey AWPDRNWWEKETRV-QBFSEMIESA-N
Mol Weight 274.38 g/mol
Molecular Formula C15H18N2OS
Exact Mass 274.113984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DxgBegLK4
Name 5-Benzylidene-3-pentyl-2-thioxoimidazolidin-4-one
Alternate Name(s) (Z)-5-benzylidene-3-pentyl-2-thioxoimidazolidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18N2OS
InChI InChI=1S/C15H18N2OS/c1-2-3-7-10-17-14(18)13(16-15(17)19)11-12-8-5-4-6-9-12/h4-6,8-9,11H,2-3,7,10H2,1H3,(H,16,19)/b13-11-
InChIKey AWPDRNWWEKETRV-QBFSEMIESA-N
Literature Reference DOI 10.1002/hc.10160
Molecular Weight 274.382 g/mol
SMILES N1C(N(C(\C1=C/c1ccccc1)=O)CCCCC)=S
SPLASH splash10-01i9-9310000000-7fe43e848859b6d58431
Source of Spectrum HAC-14-350-3c
Wiley ID 1775912