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3-Indolizineacetic acid, octahydro-5-propyl-, ethyl ester, (3.alpha.,5.beta.,8a.beta.)-
SpectraBase Compound ID HqkVOESrAPG
InChI InChI=1S/C15H27NO2/c1-3-6-12-7-5-8-13-9-10-14(16(12)13)11-15(17)18-4-2/h12-14H,3-11H2,1-2H3/t12-,13+,14+/m0/s1
InChIKey XLLWYNLDUYBQRE-BFHYXJOUSA-N
Mol Weight 253.39 g/mol
Molecular Formula C15H27NO2
Exact Mass 253.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JahI8SJY5Op
Name 3-Indolizineacetic acid, octahydro-5-propyl-, ethyl ester, (3.alpha.,5.beta.,8a.beta.)-
CAS Registry Number 82979-21-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H27NO2
InChI InChI=1S/C15H27NO2/c1-3-6-12-7-5-8-13-9-10-14(16(12)13)11-15(17)18-4-2/h12-14H,3-11H2,1-2H3/t12-,13+,14+/m0/s1
InChIKey XLLWYNLDUYBQRE-BFHYXJOUSA-N
Molecular Weight 253.386 g/mol
SMILES [C@@]1(N2[C@@](CC1)(CCC[C@@]2(CCC)[H])[H])(CC(=O)OCC)[H]
SPLASH splash10-03k9-0790000000-8af85f2771b65de49946
Source of Spectrum J-47-4408-0
Synonyms Ethyl[(3R,5S,8aR)-5-propyloctahydro-3-indolizinyl]acetate Ethyl[rel-(2R,6S,9S)-9-butyl-2-propyl-1-azabicyclo[4.3.0]nonan-9-yl]acetate
Wiley ID 1256861