SpectraBase Spectrum ID |
9uabDSiS9Pe |
Name |
1H-isoindole-2-acetic acid, 2,3-dihydro-1-oxo-alpha-[[(phenylmethyl)thio]methyl]-, (alpha~2~R)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
327.092914582 u |
Formula |
C18H17NO3S |
InChI |
InChI=1S/C18H17NO3S/c20-17-15-9-5-4-8-14(15)10-19(17)16(18(21)22)12-23-11-13-6-2-1-3-7-13/h1-9,16H,10-12H2,(H,21,22) |
InChIKey |
WZPSONKWURQFRI-UHFFFAOYSA-N |
Molecular Weight |
327.398 g/mol |
NMR Offset |
18.0969 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_665 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12669894 |
Temperature |
29.85 °C |