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(3S*,3aS*,6aR*)-1-Methyl-3-[1-(phenylthio)ethenyl]hexahydro-1H-cyclopent[c]isoxazole
SpectraBase Compound ID 73uDJ2Om1mL
InChI InChI=1S/C15H19NOS/c1-11(18-12-7-4-3-5-8-12)15-13-9-6-10-14(13)16(2)17-15/h3-5,7-8,13-15H,1,6,9-10H2,2H3/t13-,14+,15+/m0/s1
InChIKey XWWUKTCMSMUFSR-RRFJBIMHSA-N
Mol Weight 261.38 g/mol
Molecular Formula C15H19NOS
Exact Mass 261.118735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EjwPEuqdWhS
Name (3S*,3aS*,6aR*)-1-Methyl-3-[1-(phenylthio)ethenyl]hexahydro-1H-cyclopent[c]isoxazole
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Formula C15H19NOS
InChI InChI=1S/C15H19NOS/c1-11(18-12-7-4-3-5-8-12)15-13-9-6-10-14(13)16(2)17-15/h3-5,7-8,13-15H,1,6,9-10H2,2H3/t13-,14+,15+/m0/s1
InChIKey XWWUKTCMSMUFSR-RRFJBIMHSA-N
Molecular Weight 261.383 g/mol
SMILES [C@]1(ON(C)[C@]2([C@@]1(CCC2)[H])[H])(C(Sc1ccccc1)=C)[H]
SPLASH splash10-0h90-7910000000-6d139eef0d8987d61fa8
Source of Spectrum QA-45-168-7
Synonyms (3S,3aS,6aR)-1-methyl-3-[1-(phenylsulfanyl)vinyl]hexahydro-1H-cyclopenta[c]isoxazole 1-[(3S,3aS,6aR)-1-methylhexahydro-1H-cyclopenta[c]isoxazol-3-yl]vinyl phenyl sulfide
Wiley ID 862728