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Epimeric Methyl N-[(1R,2E,4R)-bornan-2-ylidene]-(S/R)-phenylalaninate [dis. methyl (S/R)-3'-phenyl-2'-([1R,2E,4R)-1,7,7,trimethylbicyclo[2.2.1]heptan-2-ylideneamino)propanoate]

View entire compound with spectra: 2 MS (GC)

Epimeric Methyl N-[(1R,2E,4R)-bornan-2-ylidene]-(S/R)-phenylalaninate [dis. methyl (S/R)-3'-phenyl-2'-([1R,2E,4R)-1,7,7,trimethylbicyclo[2.2.1]heptan-2-ylideneamino)propanoate]
SpectraBase Compound ID BVlfLLCyizn
InChI InChI=1S/C20H27NO2/c1-19(2)15-10-11-20(19,3)17(13-15)21-16(18(22)23-4)12-14-8-6-5-7-9-14/h5-9,15-16H,10-13H2,1-4H3/b21-17+/t15-,16-,20+/m0/s1
InChIKey NODUOEKLDVTWBG-TUVGFZERSA-N
Mol Weight 313.44 g/mol
Molecular Formula C20H27NO2
Exact Mass 313.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gewtc3Bsver
Name Epimeric Methyl N-[(1R,2E,4R)-bornan-2-ylidene]-(S/R)-phenylalaninate [dis. methyl (S/R)-3'-phenyl-2'-([1R,2E,4R)-1,7,7,trimethylbicyclo[2.2.1]heptan-2-ylideneamino)propanoate]
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Formula C20H27NO2
InChI InChI=1S/C20H27NO2/c1-19(2)15-10-11-20(19,3)17(13-15)21-16(18(22)23-4)12-14-8-6-5-7-9-14/h5-9,15-16H,10-13H2,1-4H3/b21-17+/t15-,16-,20+/m0/s1
InChIKey NODUOEKLDVTWBG-TUVGFZERSA-N
Molecular Weight 313.441 g/mol
SMILES [C@]12(\C(=N\[C@](C(=O)OC)(Cc3ccccc3)[H])C[C@@](C1(C)C)(CC2)[H])C
SPLASH splash10-00di-2090000000-df85d2d030cfd75a1c0c
Source of Spectrum K-2001-256-5
Synonyms Methyl N-[(1R,2E,4R)-bornan-2-ylidene]-(S)-phenylalaninate [methyl (S)-3'-phenyl-2'-([1R,2E,4R]-1,7,7,trimethylbicyclo[2.2.1]heptan-2-ylideneamino)propanoate]
Wiley ID 1578511