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2-(Octan-2-yl)-1H-indole
SpectraBase Compound ID LZjdPqvk83N
InChI InChI=1S/C16H23N/c1-3-4-5-6-9-13(2)16-12-14-10-7-8-11-15(14)17-16/h7-8,10-13,17H,3-6,9H2,1-2H3
InChIKey KWCKSBVOZFIGMC-UHFFFAOYSA-N
Mol Weight 229.37 g/mol
Molecular Formula C16H23N
Exact Mass 229.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9n3GENA4VDg
Name 2-(Octan-2-yl)-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 229.183049745 u
Formula C16H23N
InChI InChI=1S/C16H23N/c1-3-4-5-6-9-13(2)16-12-14-10-7-8-11-15(14)17-16/h7-8,10-13,17H,3-6,9H2,1-2H3
InChIKey KWCKSBVOZFIGMC-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/anie.201704196
Molecular Weight 229.367 g/mol
Quality 45
Reported Formula C16H23N
SMILES N1C=2C=CC=CC2C=C1C(CCCCCC)C
SPLASH splash10-0006-0920000000-dae5a1ee1b9eb4455769
Source of Spectrum ACI-56-SM59-S-2 (DOI: 10.1002/anie.201704196)
Wiley ID 1896284