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(3R,6R,9S)-2-Oxo-3-(N-benzyloxycarbonyl)amino-9-(methoxycarbonyl)-1-azabicyclo[4.3.0]nonane
SpectraBase Compound ID LMUZnR6U2Kj
InChI InChI=1S/C18H22N2O5/c1-24-17(22)15-10-8-13-7-9-14(16(21)20(13)15)19-18(23)25-11-12-5-3-2-4-6-12/h2-6,13-15H,7-11H2,1H3,(H,19,23)/t13-,14-,15+/m1/s1
InChIKey HEOARTLXMIRFJV-KFWWJZLASA-N
Mol Weight 346.38 g/mol
Molecular Formula C18H22N2O5
Exact Mass 346.152872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BWdisfM9afm
Name (3R,6R,9S)-2-Oxo-3-(N-benzyloxycarbonyl)amino-9-(methoxycarbonyl)-1-azabicyclo[4.3.0]nonane
Alternate Name(s) (3R,6R,9S)-2-Oxo-3-amino-(N-benzyloxycarbonyl)-9-(methoxycarbonyl)-1-azabicyclo[4.3.0]nonane Methyl (3S,6R,8aR)-6-{[(benzyloxy)carbonyl]amino}-5-oxooctahydro-3-indolizinecarboxylate
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Formula C18H22N2O5
InChI InChI=1S/C18H22N2O5/c1-24-17(22)15-10-8-13-7-9-14(16(21)20(13)15)19-18(23)25-11-12-5-3-2-4-6-12/h2-6,13-15H,7-11H2,1H3,(H,19,23)/t13-,14-,15+/m1/s1
InChIKey HEOARTLXMIRFJV-KFWWJZLASA-N
Molecular Weight 346.383 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@]1(C(N2[C@](C(=O)OC)(CC[C@]2(CC1)[H])[H])=O)[H]
SPLASH splash10-000f-9462000000-6c4ee4139f4d524e83fb
Source of Spectrum F-56-4294-14
Wiley ID 857529