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[(1S,2R,4R)-1-(Benzylthiomethyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-yl]-amine
SpectraBase Compound ID Hir0fnRxTDb
InChI InChI=1S/C17H25NS/c1-16(2)14-8-9-17(16,15(18)10-14)12-19-11-13-6-4-3-5-7-13/h3-7,14-15H,8-12,18H2,1-2H3/t14-,15+,17-/m0/s1
InChIKey IPBHXKSQIUWRHG-UXLLHSPISA-N
Mol Weight 275.45 g/mol
Molecular Formula C17H25NS
Exact Mass 275.170771 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qqP7w5s27u
Name [(1S,2R,4R)-1-(Benzylthiomethyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-yl]-amine
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Formula C17H25NS
InChI InChI=1S/C17H25NS/c1-16(2)14-8-9-17(16,15(18)10-14)12-19-11-13-6-4-3-5-7-13/h3-7,14-15H,8-12,18H2,1-2H3/t14-,15+,17-/m0/s1
InChIKey IPBHXKSQIUWRHG-UXLLHSPISA-N
Molecular Weight 275.454 g/mol
SMILES N[C@]1([C@@]2(C([C@@]([H])(CC2)C1)(C)C)CSCc1ccccc1)[H]
SPLASH splash10-004i-3790000000-f653ca127e301e94cc7a
Source of Spectrum F5-2-1891-6d
Synonyms (1S,2R,4R)-1-((benzylthio)methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-amine (1R,3R,4S)-7,7-dimethyl-4-[(phenylmethylthio)methyl]-3-bicyclo[2.2.1]heptanamine (1R,3R,4S)-4-(benzylsulfanylmethyl)-7,7-dimethylbicyclo[2.2.1]heptan-3-amine (1S,2R,4R)-1-(benzylsulfanylmethyl)-7,7-dimethyl-norbornan-2-amine (1R,3R,4S)-7,7-dimethyl-4-[(phenylmethylsulfanyl)methyl]bicyclo[2.2.1]heptan-3-amine
Wiley ID 1731930