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1,3-propanediamine, N~1~-[4-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]-2-(2-furanyl)-5-oxazolyl]-N~3~,N~3~-diethyl-
SpectraBase Compound ID LSXZVE9Ge3
InChI InChI=1S/C22H27N3O6S/c1-3-25(4-2)11-6-10-23-21-22(24-20(31-21)18-7-5-12-28-18)32(26,27)16-8-9-17-19(15-16)30-14-13-29-17/h5,7-9,12,15,23H,3-4,6,10-11,13-14H2,1-2H3
InChIKey QASSLNGFKVCFQX-UHFFFAOYSA-N
Mol Weight 461.53 g/mol
Molecular Formula C22H27N3O6S
Exact Mass 461.162057 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3Fh4iqKSK3A
Name 1,3-propanediamine, N~1~-[4-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]-2-(2-furanyl)-5-oxazolyl]-N~3~,N~3~-diethyl-
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/C22H27N3O6S/c1-3-25(4-2)11-6-10-23-21-22(24-20(31-21)18-7-5-12-28-18)32(26,27)16-8-9-17-19(15-16)30-14-13-29-17/h5,7-9,12,15,23H,3-4,6,10-11,13-14H2,1-2H3
InChIKey QASSLNGFKVCFQX-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_7729
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: F30953; Labnumber: TVIN-01691