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1H-isoindole-2-acetic acid, 2,3-dihydro-1-oxo-alpha-[[(phenylmethyl)thio]methyl]-, (alpha~2~R)-
SpectraBase Compound ID GAZAjekwGwp
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
Mol Weight 327.4 g/mol
Molecular Formula C18H17NO3S
Exact Mass 327.092915 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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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