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(5'R,6'R,7'R)-7'-Hydroxymethyl-5'-methylspiro[cyclohexane-1,2'-[3]oxa[1]azabicyclo[4.2.0]octane]-8-one
SpectraBase Compound ID 1XZ2URgRFh7
InChI InChI=1S/C13H21NO3/c1-9-8-17-13(5-3-2-4-6-13)14-11(9)10(7-15)12(14)16/h9-11,15H,2-8H2,1H3/t9-,10+,11+/m0/s1
InChIKey RKTMTQDBXITCJD-HBNTYKKESA-N
Mol Weight 239.31 g/mol
Molecular Formula C13H21NO3
Exact Mass 239.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DUiKES7vCxt
Name (5'R,6'R,7'R)-7'-Hydroxymethyl-5'-methylspiro[cyclohexane-1,2'-[3]oxa[1]azabicyclo[4.2.0]octane]-8-one
Comments Less than 3 mono-isotopic peaks
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Formula C13H21NO3
InChI InChI=1S/C13H21NO3/c1-9-8-17-13(5-3-2-4-6-13)14-11(9)10(7-15)12(14)16/h9-11,15H,2-8H2,1H3/t9-,10+,11+/m0/s1
InChIKey RKTMTQDBXITCJD-HBNTYKKESA-N
Molecular Weight 239.315 g/mol
SMILES OC[C@@]1([C@@]2(N(C1=O)C1(OC[C@@]2(C)[H])CCCCC1)[H])[H]
SPLASH splash10-0002-0930000000-c773cf2cd6cef00f545d
Source of Spectrum H1-52-882-5
Synonyms (5R,6R,7S)-7-(hydroxymethyl)-5-methyl-8-spiro[3-oxa-1-azabicyclo[4.2.0]octane-2,1'-cyclohexane]one (5R,6R,7S)-7-(hydroxymethyl)-5-methylspiro[3-oxa-1-azabicyclo[4.2.0]octane-2,1'-cyclohexane]-8-one (5R,6R,7S)-7-(hydroxymethyl)-5-methyl-spiro[3-oxa-1-azabicyclo[4.2.0]octane-2,1'-cyclohexane]-8-one
Wiley ID 817656