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6-(Phenylthio)bicyclo[2.2.1]hept-5-en-2-one ethylene ketal
SpectraBase Compound ID 8T7y8NpWOnr
InChI InChI=1S/C15H16O2S/c1-2-4-12(5-3-1)18-14-9-11-8-13(14)15(10-11)16-6-7-17-15/h1-5,9,11,13H,6-8,10H2/t11-,13+/m0/s1
InChIKey HQUWUMXOZXCSFH-WCQYABFASA-N
Mol Weight 260.35 g/mol
Molecular Formula C15H16O2S
Exact Mass 260.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BN23DRGSqsp
Name 6-(Phenylthio)bicyclo[2.2.1]hept-5-en-2-one ethylene ketal
CAS Registry Number 119595-42-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O2S
InChI InChI=1S/C15H16O2S/c1-2-4-12(5-3-1)18-14-9-11-8-13(14)15(10-11)16-6-7-17-15/h1-5,9,11,13H,6-8,10H2/t11-,13+/m0/s1
InChIKey HQUWUMXOZXCSFH-WCQYABFASA-N
Molecular Weight 260.351 g/mol
SMILES [C@@]12(C3(C[C@@](C2)(C=C1Sc1ccccc1)[H])OCCO3)[H]
SPLASH splash10-062i-9610000000-1214cd04da7eebd174c2
Source of Spectrum J-54-2631-30
Synonyms 6-(Phenylsulfanyl)spiro[bicyclo[2.2.1]heptane-2,2'-[1,3]dioxolan]-5-ene 6-Phenylthio-bicyclo(2,2,1)hept-5-en-2-one ethylene ketal
Wiley ID 1263728