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

View entire compound with spectra: 1 NMR

3-quinolinecarboxylic acid, 4-[4-(acetyloxy)-3-methoxyphenyl]-1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-, 2-(ethylthio)ethyl ester
SpectraBase Compound ID F6APRIQeBsM
InChI InChI=1S/C26H33NO6S/c1-7-34-11-10-32-25(30)22-15(2)27-18-13-26(4,5)14-19(29)24(18)23(22)17-8-9-20(33-16(3)28)21(12-17)31-6/h8-9,12,23,27H,7,10-11,13-14H2,1-6H3
InChIKey HZKQVAHJSCUXRU-UHFFFAOYSA-N
Mol Weight 487.6 g/mol
Molecular Formula C26H33NO6S
Exact Mass 487.202859 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IFHxmUsjiKA
Name 3-quinolinecarboxylic acid, 4-[4-(acetyloxy)-3-methoxyphenyl]-1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-, 2-(ethylthio)ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 487.202858955 u
Formula C26H33NO6S
InChI InChI=1S/C26H33NO6S/c1-7-34-11-10-32-25(30)22-15(2)27-18-13-26(4,5)14-19(29)24(18)23(22)17-8-9-20(33-16(3)28)21(12-17)31-6/h8-9,12,23,27H,7,10-11,13-14H2,1-6H3
InChIKey HZKQVAHJSCUXRU-UHFFFAOYSA-N
Molecular Weight 487.611 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_868
Solvent DMSO-d6
Source Vendor ID: ZI/8103676; Lab Info: SAS; Lab Number: SAS-0051064