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N-[(1-acetyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-beta-alanine
SpectraBase Compound ID Jocqli2tbAc
InChI InChI=1S/C13H16N2O5S/c1-9(16)15-7-5-10-8-11(2-3-12(10)15)21(19,20)14-6-4-13(17)18/h2-3,8,14H,4-7H2,1H3,(H,17,18)
InChIKey AUTZTZHBEWMTCY-UHFFFAOYSA-N
Mol Weight 312.34 g/mol
Molecular Formula C13H16N2O5S
Exact Mass 312.077993 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Elo69SnlGrA
Name N-[(1-acetyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-beta-alanine
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.077992792 u
Formula C13H16N2O5S
InChI InChI=1S/C13H16N2O5S/c1-9(16)15-7-5-10-8-11(2-3-12(10)15)21(19,20)14-6-4-13(17)18/h2-3,8,14H,4-7H2,1H3,(H,17,18)
InChIKey AUTZTZHBEWMTCY-UHFFFAOYSA-N
Molecular Weight 312.340 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5668
Solvent DMSO-d6
Source Vendor ID: NMR/12329706
Temperature 23.85 °C