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(5r6t)-5,6-Epoxy-5-methyl-1-hepten-3-yl Phenyl Sulfide
SpectraBase Compound ID 9skyqcXsrtc
InChI InChI=1S/C14H18OS/c1-12-14(2,15-12)10-6-7-11-16-13-8-4-3-5-9-13/h3-5,7-9,11-12H,6,10H2,1-2H3/b11-7+/t12-,14+/m0/s1
InChIKey LSISHGAEQGZNJE-CGVJRUOMSA-N
Mol Weight 234.36 g/mol
Molecular Formula C14H18OS
Exact Mass 234.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Ck7fRXW9A
Name (5r6t)-5,6-Epoxy-5-methyl-1-hepten-3-yl Phenyl Sulfide
Alternate Name(s) (2R,3S)-2,3-dimethyl-2-[(1E)-4-(phenylsulfanyl)-1-butenyl]oxirane (3E)-4-[(2R,3S)-2,3-dimethyloxiranyl]-3-butenyl phenyl sulfide (5r6t)-5,6-Epoxy-5-methyl-1-hepten-1-yl Phenyl Sulfide
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Formula C14H18OS
InChI InChI=1S/C14H18OS/c1-12-14(2,15-12)10-6-7-11-16-13-8-4-3-5-9-13/h3-5,7-9,11-12H,6,10H2,1-2H3/b11-7+/t12-,14+/m0/s1
InChIKey LSISHGAEQGZNJE-CGVJRUOMSA-N
Molecular Weight 234.357 g/mol
SMILES [C@]1(O[C@]1(C)[H])(CC\C=C\Sc1ccccc1)C
SPLASH splash10-06v0-1940000000-03cf5ca678a168b5381d
Source of Spectrum J-58-629-5
Wiley ID 1236068