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4-Phenylsulfanyl-octahydroindan-2-one
SpectraBase Compound ID C9Hn46vr2pP
InChI InChI=1S/C15H18OS/c16-12-9-11-5-4-8-15(14(11)10-12)17-13-6-2-1-3-7-13/h1-3,6-7,11,14-15H,4-5,8-10H2/t11-,14+,15+/m1/s1
InChIKey RKESRUGYJWKCCR-UGFHNGPFSA-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 25ww5wTEhJX
Name 4-Phenylsulfanyl-octahydroindan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18OS
InChI InChI=1S/C15H18OS/c16-12-9-11-5-4-8-15(14(11)10-12)17-13-6-2-1-3-7-13/h1-3,6-7,11,14-15H,4-5,8-10H2/t11-,14+,15+/m1/s1
InChIKey RKESRUGYJWKCCR-UGFHNGPFSA-N
Molecular Weight 246.368 g/mol
SMILES [C@]12([C@@](Sc3ccccc3)(CCC[C@@]1(CC(C2)=O)[H])[H])[H]
SPLASH splash10-07vj-9310000000-cd47a9d2a5641519317d
Source of Spectrum F-55-859-31
Synonyms 4-(Phenylsulfanyl)octahydro-2H-inden-2-one
Wiley ID 836584