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benzoic acid, 4-[(3aS,4R,9bR)-3a,4,5,9b-tetrahydro-6-methyl-3H-cyclopenta[c]quinolin-4-yl]-, methyl ester
SpectraBase Compound ID JkcV9fVO3p7
InChI InChI=1S/C21H21NO2/c1-13-5-3-7-17-16-6-4-8-18(16)20(22-19(13)17)14-9-11-15(12-10-14)21(23)24-2/h3-7,9-12,16,18,20,22H,8H2,1-2H3
InChIKey ADEBLGYHVFGESX-UHFFFAOYSA-N
Mol Weight 319.4 g/mol
Molecular Formula C21H21NO2
Exact Mass 319.157229 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FJUvPKJAJAR
Name benzoic acid, 4-[(3aS,4R,9bR)-3a,4,5,9b-tetrahydro-6-methyl-3H-cyclopenta[c]quinolin-4-yl]-, methyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H21NO2/c1-13-5-3-7-17-16-6-4-8-18(16)20(22-19(13)17)14-9-11-15(12-10-14)21(23)24-2/h3-7,9-12,16,18,20,22H,8H2,1-2H3
InChIKey ADEBLGYHVFGESX-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_4912
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/12218050