SpectraBase Spectrum ID |
KTiwc3DenYV |
Name |
3-quinolinecarboxylic acid, 4-(2-chloro-5-nitrophenyl)-1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-, 2-phenoxyethyl 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/C27H27ClN2O6/c1-16-23(26(32)36-12-11-35-18-7-5-4-6-8-18)24(19-13-17(30(33)34)9-10-20(19)28)25-21(29-16)14-27(2,3)15-22(25)31/h4-10,13,24,29H,11-12,14-15H2,1-3H3 |
InChIKey |
KYJJDDDZQKACER-UHFFFAOYSA-N |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_CB_8313_6246 |
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/10252215; Labnumber: SAS-tst3826 |
Temperature |
303 °C |