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3-[(1S)-1-phenylethyl]-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylic acid methyl ester
SpectraBase Compound ID GC4oSlWzA9D
InChI InChI=1S/C16H19NO2/c1-11(12-6-4-3-5-7-12)17-14-9-8-13(10-14)15(17)16(18)19-2/h3-9,11,13-15H,10H2,1-2H3/t11-,13-,14+,15-/m0/s1
InChIKey PWUWUKQPSOGOPL-MHEUCROKSA-N
Mol Weight 257.33 g/mol
Molecular Formula C16H19NO2
Exact Mass 257.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfMHUvCnR7s
Name 3-[(1S)-1-phenylethyl]-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylic acid methyl ester
Alternate Name(s) Methyl 3-[(1S)-1-phenylethyl]-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO2
InChI InChI=1S/C16H19NO2/c1-11(12-6-4-3-5-7-12)17-14-9-8-13(10-14)15(17)16(18)19-2/h3-9,11,13-15H,10H2,1-2H3/t11-,13-,14+,15-/m0/s1
InChIKey PWUWUKQPSOGOPL-MHEUCROKSA-N
Molecular Weight 257.333 g/mol
SMILES [C@@]12(N([C@@]([C@@](C=C2)(C1)[H])(C(=O)OC)[H])[C@](c1ccccc1)(C)[H])[H]
SPLASH splash10-054o-9510000000-b90ce1509c594e341767
Source of Spectrum AT-31-2606-4
Wiley ID 835691