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3-Benzyl-5-benzylidene-2-hexylsulfanyl-imidazol-4-one
SpectraBase Compound ID CPdAdUgA21E
InChI InChI=1S/C23H26N2OS/c1-2-3-4-11-16-27-23-24-21(17-19-12-7-5-8-13-19)22(26)25(23)18-20-14-9-6-10-15-20/h5-10,12-15,17H,2-4,11,16,18H2,1H3/b21-17-
InChIKey RYLKOKKQCGYDNU-FXBPSFAMSA-N
Mol Weight 378.53 g/mol
Molecular Formula C23H26N2OS
Exact Mass 378.176585 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PNEF3QHl1L
Name 3-Benzyl-5-benzylidene-2-hexylsulfanyl-imidazol-4-one
Alternate Name(s) (Z)-1-benzyl-4-benzylidene-2-(hexylthio)-1H-imidazol-5(4H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26N2OS
InChI InChI=1S/C23H26N2OS/c1-2-3-4-11-16-27-23-24-21(17-19-12-7-5-8-13-19)22(26)25(23)18-20-14-9-6-10-15-20/h5-10,12-15,17H,2-4,11,16,18H2,1H3/b21-17-
InChIKey RYLKOKKQCGYDNU-FXBPSFAMSA-N
Literature Reference DOI 10.1002/hc.10160
Molecular Weight 378.534 g/mol
SMILES C1(=O)\C(N=C(SCCCCCC)N1Cc1ccccc1)=C\c1ccccc1
SPLASH splash10-002f-3079000000-3079ceda706caeb05e7e
Source of Spectrum HAC-14-350-4f
Wiley ID 1775924