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[(1R,2S,3S,4S)-3-(1,1-Dimethylethyl)bicyclo[2.2.1]hept-5-en-2-yl-(1-oxidopyridin-2-yl)methanone
SpectraBase Compound ID 4AiDxAcVeGC
InChI InChI=1S/C17H21NO2/c1-17(2,3)15-12-8-7-11(10-12)14(15)16(19)13-6-4-5-9-18(13)20/h4-9,11-12,14-15H,10H2,1-3H3/t11-,12+,14-,15-/m0/s1
InChIKey QDIFKMMWHOYTHB-NEBZKDRISA-N
Mol Weight 271.36 g/mol
Molecular Formula C17H21NO2
Exact Mass 271.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmyCyPY5Q24
Name [(1R,2S,3S,4S)-3-(1,1-Dimethylethyl)bicyclo[2.2.1]hept-5-en-2-yl-(1-oxidopyridin-2-yl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO2
InChI InChI=1S/C17H21NO2/c1-17(2,3)15-12-8-7-11(10-12)14(15)16(19)13-6-4-5-9-18(13)20/h4-9,11-12,14-15H,10H2,1-3H3/t11-,12+,14-,15-/m0/s1
InChIKey QDIFKMMWHOYTHB-NEBZKDRISA-N
Molecular Weight 271.360 g/mol
SMILES C=1[C@@]2(C[C@]([C@@]([C@]2(C(C)(C)C)[H])(C(=O)c2[n+](cccc2)[O-])[H])([H])C1)[H]
SPLASH splash10-05fr-0090000000-4afafe053a2bea2ce06f
Source of Spectrum H-95-2083-endo_28
Synonyms 2-((1R,2R,3S,4S)-3-(tert-butyl)bicyclo[2.2.1]hept-5-ene-2-carbonyl)pyridine 1-oxide
Wiley ID 1784193