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3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-, 2-(ethylthio)ethyl ester

View entire compound with spectra: 1 NMR

3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-, 2-(ethylthio)ethyl ester
SpectraBase Compound ID IXr5yPyCKTg
InChI InChI=1S/C26H35NO6S/c1-8-34-10-9-33-25(29)22-15(2)27-17-13-26(3,4)14-18(28)24(17)23(22)16-11-20(31-6)21(32-7)12-19(16)30-5/h11-12,23,27H,8-10,13-14H2,1-7H3
InChIKey HWYYNPAIDNHBCS-UHFFFAOYSA-N
Mol Weight 489.6 g/mol
Molecular Formula C26H35NO6S
Exact Mass 489.218509 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FP3klOS8pBY
Name 3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-, 2-(ethylthio)ethyl ester
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 489.218509019 u
Formula C26H35NO6S
InChI InChI=1S/C26H35NO6S/c1-8-34-10-9-33-25(29)22-15(2)27-17-13-26(3,4)14-18(28)24(17)23(22)16-11-20(31-6)21(32-7)12-19(16)30-5/h11-12,23,27H,8-10,13-14H2,1-7H3
InChIKey HWYYNPAIDNHBCS-UHFFFAOYSA-N
Molecular Weight 489.627 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2322
Solvent DMSO-d6
Source Vendor ID: NMR/9223192; Lab Info: SAS; Lab Number: SAS-TST0680
Temperature 29.85 °C