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4-Benzyl-5-(t-butyl)thiophen-2(5H)-one
SpectraBase Compound ID 8pENqy0c6Uc
InChI InChI=1S/C15H18OS/c1-15(2,3)14-12(10-13(16)17-14)9-11-7-5-4-6-8-11/h4-8,10,14H,9H2,1-3H3
InChIKey GDWYDGJGVIEPDD-UHFFFAOYSA-N
Mol Weight 246.37 g/mol
Molecular Formula C15H18OS
Exact Mass 246.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6YycMkUfk3N
Name 4-Benzyl-5-(t-butyl)thiophen-2(5H)-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18OS
InChI InChI=1S/C15H18OS/c1-15(2,3)14-12(10-13(16)17-14)9-11-7-5-4-6-8-11/h4-8,10,14H,9H2,1-3H3
InChIKey GDWYDGJGVIEPDD-UHFFFAOYSA-N
Molecular Weight 246.368 g/mol
SMILES C=1(C(SC(C1)=O)C(C)(C)C)Cc1ccccc1
SPLASH splash10-0006-0900000000-a5fa40c311cff564a6e0
Source of Spectrum H-80-513-6
Synonyms 4-benzyl-5-tert-butyl-2(5H)-thiophenone
Wiley ID 1249136