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(3aS,4S,7aR)-3a,4-cis-3a,7a-cis-4-Hydroxy-3-phenyl-3a,4,5,6,7,7a-hexahydro-1,2-benzisoxazole
SpectraBase Compound ID 330O8Yw4L81
InChI InChI=1S/C13H15NO2/c15-10-7-4-8-11-12(10)13(14-16-11)9-5-2-1-3-6-9/h1-3,5-6,10-12,15H,4,7-8H2/t10-,11+,12-/m0/s1
InChIKey DDLOVHHHXCMVIJ-TUAOUCFPSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KXK6JPmnuaa
Name (3aS,4S,7aR)-3a,4-cis-3a,7a-cis-4-Hydroxy-3-phenyl-3a,4,5,6,7,7a-hexahydro-1,2-benzisoxazole
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Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c15-10-7-4-8-11-12(10)13(14-16-11)9-5-2-1-3-6-9/h1-3,5-6,10-12,15H,4,7-8H2/t10-,11+,12-/m0/s1
InChIKey DDLOVHHHXCMVIJ-TUAOUCFPSA-N
Molecular Weight 217.268 g/mol
SMILES O[C@@]1([C@@]2(C(=NO[C@@]2(CCC1)[H])c1ccccc1)[H])[H]
SPLASH splash10-0002-1900000000-689669b69ba9fc84ee1b
Source of Spectrum H1-51-643-2
Synonyms (3aS,4S,7aR)-3-phenyl-3a,4,5,6,7,7a-hexahydro-1,2-benzisoxazol-4-ol 3a,4-cis-3a,7a-cis-4-Hydroxy-3-phenyl-3a,4,5,6,7,7a-hexahydro-1,2-benzisoxazole
Wiley ID 817068