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 |