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(1R,3R,4R,6S)-N,N'-Bis[(S)-1-phenylethyl]-7-oxabicyclo[4.1.0]-heptane-3,4-diamine
SpectraBase Compound ID 9Z9CHcYPCz8
InChI InChI=1S/C22H28N2O/c1-15(17-9-5-3-6-10-17)23-19-13-21-22(25-21)14-20(19)24-16(2)18-11-7-4-8-12-18/h3-12,15-16,19-24H,13-14H2,1-2H3/t15-,16-,19-,20+,21-,22+/m0/s1
InChIKey OVQQPCJCGJPIMM-LOYPTAHWSA-N
Mol Weight 336.48 g/mol
Molecular Formula C22H28N2O
Exact Mass 336.220164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hgjs1auFL7E
Name (1R,3R,4R,6S)-N,N'-Bis[(S)-1-phenylethyl]-7-oxabicyclo[4.1.0]-heptane-3,4-diamine
Alternate Name(s) (1S,3S,4R,6R)-N,N'-Bis[(S)-1-phenylethyl]-7-oxa-bicyclo[4.1.0]-heptane-3,4-diamine (1R,3R,4S,6S)-N3,N4-bis((S)-1-phenylethyl)-7-oxabicyclo[4.1.0]heptane-3,4-diamine
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Formula C22H28N2O
InChI InChI=1S/C22H28N2O/c1-15(17-9-5-3-6-10-17)23-19-13-21-22(25-21)14-20(19)24-16(2)18-11-7-4-8-12-18/h3-12,15-16,19-24H,13-14H2,1-2H3/t15-,16-,19-,20+,21-,22+/m0/s1
InChIKey OVQQPCJCGJPIMM-LOYPTAHWSA-N
Molecular Weight 336.479 g/mol
SMILES N([C@]1(C[C@@]2(O[C@@]2(C[C@]1(N[C@](c1ccccc1)(C)[H])[H])[H])[H])[H])[C@](c1ccccc1)(C)[H]
SPLASH splash10-0a4i-2910000000-b37be7b812901b9f1dd6
Source of Spectrum U1-2014-1912-4b
Wiley ID 1740645