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(1S,4R)-1-(Phenylthiomethyl)-7,7-dimethylbicyclo[2.2.1]heptaN-2-one
SpectraBase Compound ID 1lVGyiSkHls
InChI InChI=1S/C16H20OS/c1-15(2)12-8-9-16(15,14(17)10-12)11-18-13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3/t12-,16-/m0/s1
InChIKey DDPVBZFOILDOFR-LRDDRELGSA-N
Mol Weight 260.39 g/mol
Molecular Formula C16H20OS
Exact Mass 260.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWvaCDjByR6
Name (1S,4R)-1-(Phenylthiomethyl)-7,7-dimethylbicyclo[2.2.1]heptaN-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20OS
InChI InChI=1S/C16H20OS/c1-15(2)12-8-9-16(15,14(17)10-12)11-18-13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3/t12-,16-/m0/s1
InChIKey DDPVBZFOILDOFR-LRDDRELGSA-N
Molecular Weight 260.395 g/mol
SMILES [C@@]12(C([C@@]([H])(CC2)CC1=O)(C)C)CSc1ccccc1
SPLASH splash10-0ik9-0390000000-04e2c9ab7c88bddd7b53
Source of Spectrum F5-2-1890-4e
Synonyms (1S,4R)-7,7-dimethyl-1-((phenylthio)methyl)bicyclo[2.2.1]heptan-2-one (1R,4S)-7,7-dimethyl-4-[(phenylthio)methyl]-3-bicyclo[2.2.1]heptanone (1S,4R)-7,7-dimethyl-1-(phenylsulfanylmethyl)norbornan-2-one (1R,4S)-7,7-dimethyl-4-(phenylsulfanylmethyl)bicyclo[2.2.1]heptan-3-one
Wiley ID 1731876