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1-Butyl-4,7-dimethyl indole
SpectraBase Compound ID G37BwVl3kiY
InChI InChI=1S/C14H19N/c1-4-5-9-15-10-8-13-11(2)6-7-12(3)14(13)15/h6-8,10H,4-5,9H2,1-3H3
InChIKey SGTSCRMBZWQZIM-UHFFFAOYSA-N
Mol Weight 201.31 g/mol
Molecular Formula C14H19N
Exact Mass 201.15175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Zqjhlyl91A
Name 1-Butyl-4,7-dimethyl indole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 201.151749616 u
Formula C14H19N
InChI InChI=1S/C14H19N/c1-4-5-9-15-10-8-13-11(2)6-7-12(3)14(13)15/h6-8,10H,4-5,9H2,1-3H3
InChIKey SGTSCRMBZWQZIM-UHFFFAOYSA-N
Molecular Weight 201.313 g/mol
SMILES C=1N(C=2C(=CC=C(C2C1)C)C)CCCC