SpectraBase Compound ID | 1TBF8AVvaUq |
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InChI | InChI=1S/C24H26N2O9S/c1-4-34-20-9-6-14(10-21(20)33-3)19(12-22(27)35-5-2)26-36(31,32)15-7-8-18-16(11-15)23(28)17(13-25-18)24(29)30/h6-11,13,19,26H,4-5,12H2,1-3H3,(H,25,28)(H,29,30) |
InChIKey | VAJSNFCQMQFFCW-UHFFFAOYSA-N |
Mol Weight | 518.54 g/mol |
Molecular Formula | C24H26N2O9S |
Exact Mass | 518.135902 g/mol |
SpectraBase Spectrum ID | AIMh82okI7 |
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Name | 6-({[3-ethoxy-1-(4-ethoxy-3-methoxyphenyl)-3-oxopropyl]amino}sulfonyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 518.135901590 u |
Formula | C24H26N2O9S |
InChI | InChI=1S/C24H26N2O9S/c1-4-34-20-9-6-14(10-21(20)33-3)19(12-22(27)35-5-2)26-36(31,32)15-7-8-18-16(11-15)23(28)17(13-25-18)24(29)30/h6-11,13,19,26H,4-5,12H2,1-3H3,(H,25,28)(H,29,30) |
InChIKey | VAJSNFCQMQFFCW-UHFFFAOYSA-N |
Molecular Weight | 518.537 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_1500 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12269934 |