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1H-indole-2-carboxylic acid, 3-amino-5-fluoro-1-methyl-, methylester
SpectraBase Compound ID CUV2FwDNUaA
InChI InChI=1S/C11H11FN2O2/c1-14-8-4-3-6(12)5-7(8)9(13)10(14)11(15)16-2/h3-5H,13H2,1-2H3
InChIKey JJWYWXHQVDPUSP-UHFFFAOYSA-N
Mol Weight 222.22 g/mol
Molecular Formula C11H11FN2O2
Exact Mass 222.080456 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6ZEjypQa1e4
Name 1H-indole-2-carboxylic acid, 3-amino-5-fluoro-1-methyl-, methylester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.080455763 u
Formula C11H11FN2O2
InChI InChI=1S/C11H11FN2O2/c1-14-8-4-3-6(12)5-7(8)9(13)10(14)11(15)16-2/h3-5H,13H2,1-2H3
InChIKey JJWYWXHQVDPUSP-UHFFFAOYSA-N
Molecular Weight 222.219 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_8534
Solvent DMSO-d6
Source Vendor ID: NMR/12719753