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4,4A-BETA,5,6,7,8-HEXAHYDRO-5-BETA-HYDROXY-4A-TRIFLUOROMETHYL-5-VINYLNAPHTHALEN-2-(3H)-ONE
SpectraBase Compound ID 4t3nsD2ySCA
InChI InChI=1S/C13H15F3O2/c1-2-11(18)6-3-4-9-8-10(17)5-7-12(9,11)13(14,15)16/h2,8,18H,1,3-7H2/t11-,12+/m0/s1
InChIKey VIDIOSQJWGPWIM-NWDGAFQWSA-N
Mol Weight 260.26 g/mol
Molecular Formula C13H15F3O2
Exact Mass 260.102414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6LKkkO8NlbY
Name (4aR,5R)-5-Hydroxy-4a-trifluoromethyl-5-vinyl-4,4a,5,6,7,8-hexahydro-3H-naphthalen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15F3O2
InChI InChI=1S/C13H15F3O2/c1-2-11(18)6-3-4-9-8-10(17)5-7-12(9,11)13(14,15)16/h2,8,18H,1,3-7H2/t11-,12+/m0/s1
InChIKey VIDIOSQJWGPWIM-NWDGAFQWSA-N
Molecular Weight 260.256 g/mol
SMILES O[C@@]1([C@@]2(C(=CC(CC2)=O)CCC1)C(F)(F)F)C=C
SPLASH splash10-0a4i-9300000000-e0c44586fe3762929bba
Source of Spectrum KC-0-1916-5
Synonyms (4aR,5R)-5-hydroxy-4a-(trifluoromethyl)-5-vinyl-4,4a,5,6,7,8-hexahydro-2(3H)-naphthalenone 4,4a.beta.,5,6,7,8-Hexahydro-5.beta.-hydroxy-4a-(trimethylethynyl)-5-vinylnaphthalen-2(3H)-one
Wiley ID 822888