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1-(1-acetyl-1H-indol-3-yl)-2-ammonioethanesulfonate

View entire compound with spectra: 1 NMR

1-(1-acetyl-1H-indol-3-yl)-2-ammonioethanesulfonate
SpectraBase Compound ID I2jVqTosJTn
InChI InChI=1S/C12H14N2O4S/c1-8(15)14-7-10(12(6-13)19(16,17)18)9-4-2-3-5-11(9)14/h2-5,7,12H,6,13H2,1H3,(H,16,17,18)
InChIKey HGOICRCNDTXGTK-UHFFFAOYSA-N
Mol Weight 282.31 g/mol
Molecular Formula C12H14N2O4S
Exact Mass 282.067428 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LrZyHqCMyGg
Name 1-(1-acetyl-1H-indol-3-yl)-2-ammonioethanesulfonate
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/C12H14N2O4S/c1-8(15)14-7-10(12(6-13)19(16,17)18)9-4-2-3-5-11(9)14/h2-5,7,12H,6,13H2,1H3,(H,16,17,18)
InChIKey HGOICRCNDTXGTK-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28912
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: D90442; Labnumber: PRZHI-0059; SBI_ID: SBI-028916
Temperature 303 °C