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N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}-4-(1H-tetraazol-1-yl)benzamide
SpectraBase Compound ID 8bDZHWztz5c
InChI InChI=1S/C17H16N6O5S/c24-8-15(25)9-29-16-6-12(5-14(7-16)23(27)28)19-17(26)11-1-3-13(4-2-11)22-10-18-20-21-22/h1-7,10,15,24-25H,8-9H2,(H,19,26)
InChIKey RHEZSWCWNXHEPA-UHFFFAOYSA-N
Mol Weight 416.41 g/mol
Molecular Formula C17H16N6O5S
Exact Mass 416.090289 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2HRbuPPr9r8
Name N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}-4-(1H-tetraazol-1-yl)benzamide
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/C17H16N6O5S/c24-8-15(25)9-29-16-6-12(5-14(7-16)23(27)28)19-17(26)11-1-3-13(4-2-11)22-10-18-20-21-22/h1-7,10,15,24-25H,8-9H2,(H,19,26)
InChIKey RHEZSWCWNXHEPA-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8606
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: UZI/1025424; Labnumber: DMS0038; UZI_ID: UZI-008608
Temperature 308 °C