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3-Ethyl-7-(2-indolyl)-5-azabicyclo[2.2.2]oct-2-en-5-carbonsaure-methylester
SpectraBase Compound ID BFXss9j2UtW
InChI InChI=1S/C19H22N2O2/c1-3-12-8-14-11-21(19(22)23-2)18(12)10-15(14)17-9-13-6-4-5-7-16(13)20-17/h4-9,14-15,18,20H,3,10-11H2,1-2H3/t14-,15?,18+/m1/s1
InChIKey OKDFJDOYQBVVDJ-UHFFFAOYSA-N
Mol Weight 310.4 g/mol
Molecular Formula C19H22N2O2
Exact Mass 310.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPcLlxL16Rw
Name 3-Ethyl-7-(2-indolyl)-5-azabicyclo[2.2.2]oct-2-en-5-carbonsaure-methylester
CAS Registry Number 104760-78-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22N2O2
InChI InChI=1S/C19H22N2O2/c1-3-12-8-14-11-21(19(22)23-2)18(12)10-15(14)17-9-13-6-4-5-7-16(13)20-17/h4-9,14-15,18,20H,3,10-11H2,1-2H3/t14-,15?,18+/m1/s1
InChIKey OKDFJDOYQBVVDJ-UHFFFAOYSA-N
Molecular Weight 310.397 g/mol
SMILES [nH]1c2ccccc2cc1C1[C@]2(CN([C@](C(CC)=C2)(C1)[H])C(=O)OC)[H]
SPLASH splash10-00o0-0900000000-cb6e49e3ed1b8cff2b98
Source of Spectrum H-68-1843-21
Synonyms Methyl 6-ethyl-8-(1H-indol-2-yl)-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate
Wiley ID 1311776