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(3aR,4S,9bR)-8-Methoxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid (1S)-1-ethoxycarbonylphenylmethyl ester

View entire compound with spectra: 1 MS (GC)

(3aR,4S,9bR)-8-Methoxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid (1S)-1-ethoxycarbonylphenylmethyl ester
SpectraBase Compound ID 7TLygbKOWlX
InChI InChI=1S/C24H25NO5/c1-3-29-24(27)22(15-8-5-4-6-9-15)30-23(26)21-18-11-7-10-17(18)19-14-16(28-2)12-13-20(19)25-21/h4-10,12-14,17-18,21-22,25H,3,11H2,1-2H3/t17-,18-,21+,22+/m1/s1
InChIKey ABGOTGQGRDOTSX-UBBRYJJRSA-N
Mol Weight 407.47 g/mol
Molecular Formula C24H25NO5
Exact Mass 407.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66mr9k5Um9e
Name (3aR,4S,9bR)-8-Methoxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid (1S)-1-ethoxycarbonylphenylmethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H25NO5
InChI InChI=1S/C24H25NO5/c1-3-29-24(27)22(15-8-5-4-6-9-15)30-23(26)21-18-11-7-10-17(18)19-14-16(28-2)12-13-20(19)25-21/h4-10,12-14,17-18,21-22,25H,3,11H2,1-2H3/t17-,18-,21+,22+/m1/s1
InChIKey ABGOTGQGRDOTSX-UBBRYJJRSA-N
Molecular Weight 407.466 g/mol
SMILES N1c2c([C@@]3(C=CC[C@]3([C@]1(C(O[C@](C(=O)OCC)(c1ccccc1)[H])=O)[H])[H])[H])cc(cc2)OC
SPLASH splash10-05r3-0590000000-5129df7c7fb058c97a18
Source of Spectrum KC-57-6404-19
Synonyms (1S)-2-ethoxy-2-oxo-1-phenylethyl (3aR,4S,9bR)-8-methoxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylate
Wiley ID 1625160