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(1S,2S,3R,4R)-3-Phenethyloxycarbonylamino-bicyclo[2.2.1]hept-5-ene-2-carboxylic acid methyl ester
SpectraBase Compound ID LnpSKMppzwR
InChI InChI=1S/C18H21NO4/c1-22-17(20)15-13-7-8-14(11-13)16(15)19-18(21)23-10-9-12-5-3-2-4-6-12/h2-8,13-16H,9-11H2,1H3,(H,19,21)/t13-,14+,15+,16-/m1/s1
InChIKey XDFZOZKSDQFAEK-FXUDXRNXSA-N
Mol Weight 315.37 g/mol
Molecular Formula C18H21NO4
Exact Mass 315.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AcWmr4GxuUz
Name (1S,2S,3R,4R)-3-Phenethyloxycarbonylamino-bicyclo[2.2.1]hept-5-ene-2-carboxylic acid methyl ester
Alternate Name(s) (2S,3R)-3-exo-(Phenylethoxycarbonylamino)-bicyclo[2.2.1]hept-5-ene-2-exo-carboxylic acid methyl ester Methyl (1S,2S,3R,4R)-3-{[(2-phenylethoxy)carbonyl]amino}bicyclo[2.2.1]hept-5-ene-2-carboxylate
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Formula C18H21NO4
InChI InChI=1S/C18H21NO4/c1-22-17(20)15-13-7-8-14(11-13)16(15)19-18(21)23-10-9-12-5-3-2-4-6-12/h2-8,13-16H,9-11H2,1H3,(H,19,21)/t13-,14+,15+,16-/m1/s1
InChIKey XDFZOZKSDQFAEK-FXUDXRNXSA-N
Molecular Weight 315.369 g/mol
SMILES N([C@]1([C@]([C@@]2(C=C[C@]1(C2)[H])[H])(C(=O)OC)[H])[H])C(=O)OCCc1ccccc1
SPLASH splash10-0zfr-0930000000-8415fd5ee3d3f888f4f3
Source of Spectrum SO-0-1727-16
Wiley ID 878558