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5-(endo)-acetoxy-7-(anti)-phenylthiobicyclo[2.2.1]heptan-2-one
SpectraBase Compound ID 7ZpCLjVxKdn
InChI InChI=1S/C15H16O3S/c1-9(16)18-14-8-11-13(17)7-12(14)15(11)19-10-5-3-2-4-6-10/h2-6,11-12,14-15H,7-8H2,1H3
InChIKey AGHNOVNRFYPKGN-UHFFFAOYSA-N
Mol Weight 276.35 g/mol
Molecular Formula C15H16O3S
Exact Mass 276.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5igfzANjST4
Name 5-(endo)-acetoxy-7-(anti)-phenylthiobicyclo[2.2.1]heptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O3S
InChI InChI=1S/C15H16O3S/c1-9(16)18-14-8-11-13(17)7-12(14)15(11)19-10-5-3-2-4-6-10/h2-6,11-12,14-15H,7-8H2,1H3
InChIKey AGHNOVNRFYPKGN-UHFFFAOYSA-N
Molecular Weight 276.350 g/mol
SMILES C1(C2C(=O)CC1C(OC(=O)C)C2)Sc1ccccc1
SPLASH splash10-004i-0950000000-593f11788803bb2c218c
Source of Spectrum KC-1991-1797-12
Synonyms 5-Oxo-7-(phenylsulfanyl)bicyclo[2.2.1]hept-2-yl acetate
Wiley ID 1279965