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(1R*,5R*,6S*)-6-exo-Cyano-8-benzyl-8-methyl-3-methoxy-8-azabicyclo[3.2.1]oct-3-en-2-one
SpectraBase Compound ID 3Ma5veK9v2q
InChI InChI=1S/C17H18N2O2/c1-17-9-13(10-18)14(8-15(21-2)16(17)20)19(17)11-12-6-4-3-5-7-12/h3-8,13-14H,9,11H2,1-2H3/t13-,14-,17-/m1/s1
InChIKey FAAMKTKYFPWLHM-CKEIUWERSA-N
Mol Weight 282.34 g/mol
Molecular Formula C17H18N2O2
Exact Mass 282.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DhXcTTcMK7w
Name (1R*,5R*,6S*)-6-exo-Cyano-8-benzyl-8-methyl-3-methoxy-8-azabicyclo[3.2.1]oct-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2O2
InChI InChI=1S/C17H18N2O2/c1-17-9-13(10-18)14(8-15(21-2)16(17)20)19(17)11-12-6-4-3-5-7-12/h3-8,13-14H,9,11H2,1-2H3/t13-,14-,17-/m1/s1
InChIKey FAAMKTKYFPWLHM-CKEIUWERSA-N
Molecular Weight 282.343 g/mol
SMILES [C@@]12(N([C@@]([C@](C2)(C#N)[H])(C=C(C1=O)OC)[H])Cc1ccccc1)C
SPLASH splash10-0006-9300000000-d9a88bc9ab2fa4b4c588
Source of Spectrum J-61-6119-19
Synonyms (1R*,5R*,6S*)-6-exo-Cyano-8-benzyl-1-methyl-3-methoxy-8-azabicyclo[3.2.1]oct-3-en-2-one
Wiley ID 1286135