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3-Methyl-3-(2-thienyl)indan-1-one
SpectraBase Compound ID EJEzm3mp6GA
InChI InChI=1S/C14H12OS/c1-14(13-7-4-8-16-13)9-12(15)10-5-2-3-6-11(10)14/h2-8H,9H2,1H3
InChIKey CAIWFRHQNWTYAE-UHFFFAOYSA-N
Mol Weight 228.31 g/mol
Molecular Formula C14H12OS
Exact Mass 228.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CF3Pwx0My5Z
Name 3-Methyl-3-(2-thienyl)indan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12OS
InChI InChI=1S/C14H12OS/c1-14(13-7-4-8-16-13)9-12(15)10-5-2-3-6-11(10)14/h2-8H,9H2,1H3
InChIKey CAIWFRHQNWTYAE-UHFFFAOYSA-N
Molecular Weight 228.309 g/mol
SMILES C1(CC(c2ccccc12)(c1cccs1)C)=O
SPLASH splash10-03di-1390000000-93a1b7ae611c64f4b479
Source of Spectrum KC-1993-689-0
Synonyms 3-Methyl-3-thiophen-2-yl-2H-inden-1-one
Wiley ID 779231