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3-Indoleacetonitrile

View entire compound with spectra: 8 NMR, 6 FTIR, 2 Raman, and 2 MS (GC)

3-Indoleacetonitrile
SpectraBase Compound ID AYSQiNnluif
InChI InChI=1S/C10H8N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5H2
InChIKey DMCPFOBLJMLSNX-UHFFFAOYSA-N
Mol Weight 156.19 g/mol
Molecular Formula C10H8N2
Exact Mass 156.068748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID iiUYYjwyKG
Name INDOLE-3-ACETONITRILE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Boiling Point 157-160C/0.2mm
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8N2
InChI InChI=1S/C10H8N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5H2
InChIKey DMCPFOBLJMLSNX-UHFFFAOYSA-N
Melting Point 35-37C
Molecular Weight 156.19
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 3-INDOLEACETONITRILE