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3-Indole acetic acid

View entire compound with spectra: 15 NMR, 8 FTIR, 1 Raman, and 14 MS (GC)

3-Indole acetic acid
SpectraBase Compound ID 4IVbhzu0VSF
InChI InChI=1S/C10H9NO2/c12-10(13)5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H,5H2,(H,12,13)
InChIKey SEOVTRFCIGRIMH-UHFFFAOYSA-N
Mol Weight 175.19 g/mol
Molecular Formula C10H9NO2
Exact Mass 175.063329 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Da6uAWIfnNk
Name (3-Indolyl)-acetic acid
CAS Registry Number 87-51-4
Comments FROM SINGH, REASSIGNED
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Formula C10H9NO2
InChI InChI=1S/C10H9NO2/c12-10(13)5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H,5H2,(H,12,13)
InChIKey SEOVTRFCIGRIMH-UHFFFAOYSA-N
Literature Reference M.S. Morales-Rios, P. Joseph-Nathan, Magn. Res. Chem. 25, 377 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6