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2,2-diethyl-4,7-dimethyl-1-((2-(methylthio)phenyl)ethynyl)-2,3-dihydro-1H-inden-1-ol
SpectraBase Compound ID 7wLcAgGypHA
InChI InChI=1S/C24H28OS/c1-6-23(7-2)16-20-17(3)12-13-18(4)22(20)24(23,25)15-14-19-10-8-9-11-21(19)26-5/h8-13,25H,6-7,16H2,1-5H3
InChIKey LQHVPRJNNLODDK-UHFFFAOYSA-N
Mol Weight 364.55 g/mol
Molecular Formula C24H28OS
Exact Mass 364.186087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 507p3qxD0lK
Name 2,2-diethyl-4,7-dimethyl-1-((2-(methylthio)phenyl)ethynyl)-2,3-dihydro-1H-inden-1-ol
Appearance Colourless oil
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Exact Mass 364.186086695 u
Formula C24H28OS
InChI InChI=1S/C24H28OS/c1-6-23(7-2)16-20-17(3)12-13-18(4)22(20)24(23,25)15-14-19-10-8-9-11-21(19)26-5/h8-13,25H,6-7,16H2,1-5H3
InChIKey LQHVPRJNNLODDK-UHFFFAOYSA-N
Instrument Name Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/chem.202100950
Molecular Weight 364.547 g/mol
Reported Formula C24H28OS
SMILES OC1(C(CC)(CC2=C1C(=CC=C2C)C)CC)C#CC1=C(C=CC=C1)SC
SPLASH splash10-014i-0009000000-7ae0bb079c6f63b00f30
Source of Spectrum QE-27-SM8-9 (DOI: 10.1002/chem.202100950)
Thin-Layer Chromatography 0.51 (iHex/EtOAc, 9:1)
Wiley ID 1904072