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(3S,6S)-6-(Phenylmethyl)-3-methoxy-2-oxa-5-azabicyclo[2.2.1]heptane
SpectraBase Compound ID LbDHsfBFLmJ
InChI InChI=1S/C13H17NO2/c1-15-13-11-8-12(16-13)10(14-11)7-9-5-3-2-4-6-9/h2-6,10-14H,7-8H2,1H3/t10-,11?,12?,13-/m0/s1
InChIKey IXHAMTWXPHVBQQ-WTIISPKJSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J4gpcITaJJN
Name (3S,6S)-6-(Phenylmethyl)-3-methoxy-2-oxa-5-azabicyclo[2.2.1]heptane
CAS Registry Number 131100-31-7
Comments Less than 3 mono-isotopic peaks
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Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-15-13-11-8-12(16-13)10(14-11)7-9-5-3-2-4-6-9/h2-6,10-14H,7-8H2,1H3/t10-,11?,12?,13-/m0/s1
InChIKey IXHAMTWXPHVBQQ-WTIISPKJSA-N
Molecular Weight 219.284 g/mol
SMILES N1[C@](C2O[C@@](C1C2)(OC)[H])(Cc1ccccc1)[H]
SPLASH splash10-014i-9000000000-bfb45bae8c1fc5db13fa
Source of Spectrum J-56-1131-7
Synonyms (3S,6S)-6-benzyl-2-oxa-5-azabicyclo[2.2.1]hept-3-yl methyl ether (3S,6S)-6-benzyl-3-methoxy-2-oxa-5-azabicyclo[2.2.1]heptane
Wiley ID 1218940