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2-cyanoethyl 3-nitrobenzenesulfonate

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2-cyanoethyl 3-nitrobenzenesulfonate
SpectraBase Compound ID 5GHsgnaXhnY
InChI InChI=1S/C9H8N2O5S/c10-5-2-6-16-17(14,15)9-4-1-3-8(7-9)11(12)13/h1,3-4,7H,2,6H2
InChIKey ROABQIZSTLLSKT-UHFFFAOYSA-N
Mol Weight 256.23 g/mol
Molecular Formula C9H8N2O5S
Exact Mass 256.015393 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Lyn3HARxE4
Name 2-cyanoethyl 3-nitrobenzenesulfonate
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/C9H8N2O5S/c10-5-2-6-16-17(14,15)9-4-1-3-8(7-9)11(12)13/h1,3-4,7H,2,6H2
InChIKey ROABQIZSTLLSKT-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16216
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: 987/00003398; Labnumber: 987/00003398218841; VK_ID: VK-016221
Temperature 308 °C