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benzoic acid, 4-[[[(3aR,4S,9bS)-3a,4,5,9b-tetrahydro-4-(3-nitrophenyl)-3H-cyclopenta[c]quinolin-8-yl]sulfonyl]amino]-
SpectraBase Compound ID KhlY7g1Ohmx
InChI InChI=1S/C25H21N3O6S/c29-25(30)15-7-9-17(10-8-15)27-35(33,34)19-11-12-23-22(14-19)20-5-2-6-21(20)24(26-23)16-3-1-4-18(13-16)28(31)32/h1-5,7-14,20-21,24,26-27H,6H2,(H,29,30)
InChIKey VYFPVLLDAYUNLQ-UHFFFAOYSA-N
Mol Weight 491.52 g/mol
Molecular Formula C25H21N3O6S
Exact Mass 491.115107 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G2XgdxWpiRq
Name benzoic acid, 4-[[[(3aR,4S,9bS)-3a,4,5,9b-tetrahydro-4-(3-nitrophenyl)-3H-cyclopenta[c]quinolin-8-yl]sulfonyl]amino]-
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/C25H21N3O6S/c29-25(30)15-7-9-17(10-8-15)27-35(33,34)19-11-12-23-22(14-19)20-5-2-6-21(20)24(26-23)16-3-1-4-18(13-16)28(31)32/h1-5,7-14,20-21,24,26-27H,6H2,(H,29,30)
InChIKey VYFPVLLDAYUNLQ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_4950
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/12218094