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2H-1,4-Ethanoquinoline-2-carboxylic acid, 3,4-dihydro-3-oxo-, ethyl ester
SpectraBase Compound ID IO5aYmgaOJH
InChI InChI=1S/C14H15NO3/c1-2-18-14(17)12-13(16)10-7-8-15(12)11-6-4-3-5-9(10)11/h3-6,10,12H,2,7-8H2,1H3/t10-,12-/m1/s1
InChIKey YPUKKCNNKQYITA-ZYHUDNBSSA-N
Mol Weight 245.28 g/mol
Molecular Formula C14H15NO3
Exact Mass 245.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BkRrUnhlYBr
Name 2H-1,4-Ethanoquinoline-2-carboxylic acid, 3,4-dihydro-3-oxo-, ethyl ester
CAS Registry Number 34291-56-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO3
InChI InChI=1S/C14H15NO3/c1-2-18-14(17)12-13(16)10-7-8-15(12)11-6-4-3-5-9(10)11/h3-6,10,12H,2,7-8H2,1H3/t10-,12-/m1/s1
InChIKey YPUKKCNNKQYITA-ZYHUDNBSSA-N
Molecular Weight 245.278 g/mol
SMILES CCOC([C@]1(C([C@@]2(CCN1c1ccccc21)[H])=O)[H])=O
SPLASH splash10-014l-0940000000-f0831f3a3fdb0bb24e6b
Source of Spectrum OS-5-394-0
Synonyms 2-Ethoxycarbonyl-3-oxobenzo[b]quinuclidine Benzo[b]quinuclidine-2-carboxylic acid, 3-oxo-, ethyl ester Ethyl 3-Benz[b]quinuclidone-2-carboxylate
Wiley ID 1247996