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(1S,4R)-1-(Benzylthiomethyl)-7,7-dimethylbicyclo[2.2.1]heptaN-2-one
SpectraBase Compound ID DdDya4HAXfg
InChI InChI=1S/C17H22OS/c1-16(2)14-8-9-17(16,15(18)10-14)12-19-11-13-6-4-3-5-7-13/h3-7,14H,8-12H2,1-2H3/t14-,17-/m0/s1
InChIKey DPJKBJYIHZQWJO-YOEHRIQHSA-N
Mol Weight 274.42 g/mol
Molecular Formula C17H22OS
Exact Mass 274.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HlFQiQMPMvm
Name (1S,4R)-1-(Benzylthiomethyl)-7,7-dimethylbicyclo[2.2.1]heptaN-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22OS
InChI InChI=1S/C17H22OS/c1-16(2)14-8-9-17(16,15(18)10-14)12-19-11-13-6-4-3-5-7-13/h3-7,14H,8-12H2,1-2H3/t14-,17-/m0/s1
InChIKey DPJKBJYIHZQWJO-YOEHRIQHSA-N
Molecular Weight 274.422 g/mol
SMILES [C@@]12(C([C@@]([H])(CC2)CC1=O)(C)C)CSCc1ccccc1
SPLASH splash10-0089-1950000000-c225f48fc1de66c98a2a
Source of Spectrum F5-2-1890-4d
Synonyms (1S,4R)-1-((benzylthio)methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-one (1R,4S)-7,7-dimethyl-4-[(phenylmethylthio)methyl]-3-bicyclo[2.2.1]heptanone (1R,4S)-4-(benzylsulfanylmethyl)-7,7-dimethylbicyclo[2.2.1]heptan-3-one (1S,4R)-1-(benzylsulfanylmethyl)-7,7-dimethyl-norbornan-2-one (1R,4S)-7,7-dimethyl-4-[(phenylmethylsulfanyl)methyl]bicyclo[2.2.1]heptan-3-one
Wiley ID 1731877