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(3R,4S)-3-(Camphorseleno)-4-(thioacetamido)hexane
SpectraBase Compound ID 7KxSxe7FwJA
InChI InChI=1S/C18H31NOSSe/c1-6-14(19-12(3)21)15(7-2)22-11-18-9-8-13(10-16(18)20)17(18,4)5/h13-15H,6-11H2,1-5H3,(H,19,21)/t13-,14-,15+,18-/m0/s1
InChIKey GMXCBBBPMAUDMI-AFIMGQEJSA-N
Mol Weight 388.48 g/mol
Molecular Formula C18H31NOSSe
Exact Mass 389.129158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eqi2MS82Rt3
Name (3R,4S)-3-(Camphorseleno)-4-(thioacetamido)hexane
Alternate Name(s) N-((1S,2R)-2-{[(7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl)methyl]selanyl}-1-ethylbutyl)ethanethioamide
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Formula C18H31NOSSe
InChI InChI=1S/C18H31NOSSe/c1-6-14(19-12(3)21)15(7-2)22-11-18-9-8-13(10-16(18)20)17(18,4)5/h13-15H,6-11H2,1-5H3,(H,19,21)/t13-,14-,15+,18-/m0/s1
InChIKey GMXCBBBPMAUDMI-AFIMGQEJSA-N
Molecular Weight 388.484 g/mol
SMILES N([C@]([C@]([Se]C[C@]12C([C@@](CC2)(CC1=O)[H])(C)C)(CC)[H])(CC)[H])C(=S)C
SPLASH splash10-0pb9-4910000000-804215ef87ece15aafbe
Source of Spectrum KD-13-432-10
Wiley ID 1635054