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8-Phenylsulfanyl-3,4,5,6-tetrahydro-2H-oxocine

View entire compound with spectra: 1 MS (GC)

8-Phenylsulfanyl-3,4,5,6-tetrahydro-2H-oxocine
SpectraBase Compound ID 3ZIubdXx6yo
InChI InChI=1S/C13H16OS/c1-2-7-11-14-13(10-6-1)15-12-8-4-3-5-9-12/h3-5,8-10H,1-2,6-7,11H2/b13-10+
InChIKey SUNYAKJGPDATOB-JLHYYAGUSA-N
Mol Weight 220.33 g/mol
Molecular Formula C13H16OS
Exact Mass 220.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8dmahDpIOF9
Name 8-Phenylsulfanyl-3,4,5,6-tetrahydro-2H-oxocine
Alternate Name(s) 8-(Phenylsulfanyl)-3,4,5,6-tetrahydro-2H-oxocin phenyl 3,4,5,6-tetrahydro-2H-oxocin-8-yl sulfide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16OS
InChI InChI=1S/C13H16OS/c1-2-7-11-14-13(10-6-1)15-12-8-4-3-5-9-12/h3-5,8-10H,1-2,6-7,11H2/b13-10+
InChIKey SUNYAKJGPDATOB-JLHYYAGUSA-N
Molecular Weight 220.330 g/mol
SMILES C1O\C(=C/CCCC1)Sc1ccccc1
SPLASH splash10-0a4i-9200000000-3e2ce00b053cd6815e99
Source of Spectrum C5-2003-589-43
Wiley ID 1615519