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1-Octyl-3-thiocyanato-1H-indole

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1-Octyl-3-thiocyanato-1H-indole
SpectraBase Compound ID GHUbxEwhEDq
InChI InChI=1S/C17H22N2S/c1-2-3-4-5-6-9-12-19-13-17(20-14-18)15-10-7-8-11-16(15)19/h7-8,10-11,13H,2-6,9,12H2,1H3
InChIKey JUNLYLDQEBZMEI-UHFFFAOYSA-N
Mol Weight 286.44 g/mol
Molecular Formula C17H22N2S
Exact Mass 286.15037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1cbKksM5Uu
Name 1-Octyl-3-thiocyanato-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2S
InChI InChI=1S/C17H22N2S/c1-2-3-4-5-6-9-12-19-13-17(20-14-18)15-10-7-8-11-16(15)19/h7-8,10-11,13H,2-6,9,12H2,1H3
InChIKey JUNLYLDQEBZMEI-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4ra05625f
Molecular Weight 286.437 g/mol
SMILES c1cc2c(cc1)[n](CCCCCCCC)cc2SC#N
SPLASH splash10-000i-0890000000-93eb106f023a8ec345bb
Source of Spectrum RSA-4-34519/SM9-2h
Wiley ID 1751495