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3-(2-methylbutyl)-1H-indole
SpectraBase Compound ID 5dSeeCXI8bg
InChI InChI=1S/C13H17N/c1-3-10(2)8-11-9-14-13-7-5-4-6-12(11)13/h4-7,9-10,14H,3,8H2,1-2H3
InChIKey LWKYZEFHDCGBEF-UHFFFAOYSA-N
Mol Weight 187.29 g/mol
Molecular Formula C13H17N
Exact Mass 187.1361 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6L7nHvH6EUg
Name 3-(2-Methylbutyl)-1H-indole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 187.136099551 u
Formula C13H17N
InChI InChI=1S/C13H17N/c1-3-10(2)8-11-9-14-13-7-5-4-6-12(11)13/h4-7,9-10,14H,3,8H2,1-2H3
InChIKey LWKYZEFHDCGBEF-UHFFFAOYSA-N
Molecular Weight 187.286 g/mol
SMILES C1(=CNC2=C1C=CC=C2)CC(CC)C