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(Z)-1-Methyl-5-(pent-1-en-1-yl)-1H-indole
SpectraBase Compound ID CuHZdIodh3E
InChI InChI=1S/C14H17N/c1-3-4-5-6-12-7-8-14-13(11-12)9-10-15(14)2/h5-11H,3-4H2,1-2H3/b6-5-
InChIKey URBPFZQVIABMJC-WAYWQWQTSA-N
Mol Weight 199.3 g/mol
Molecular Formula C14H17N
Exact Mass 199.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I7cbc4Yd60W
Name (Z)-1-Methyl-5-(pent-1-en-1-yl)-1H-indole
Appearance Colorless oil
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Formula C14H17N
InChI InChI=1S/C14H17N/c1-3-4-5-6-12-7-8-14-13(11-12)9-10-15(14)2/h5-11H,3-4H2,1-2H3/b6-5-
InChIKey URBPFZQVIABMJC-WAYWQWQTSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI pos
Literature Reference DOI 10.1002/anie.201810327
Molecular Weight 199.297 g/mol
Reported Formula C14H17N
SMILES c1c(cc2c(c1)[n](cc2)C)\C=C/CCC
SPLASH splash10-00di-0900000000-fcc4ae7a5f63dd9f937f
Sample Comments E/Z = 12:88
Source of Spectrum ACI-58-SM28-8c
Thin-Layer Chromatography Rf = 0.17 (hexane/EtOAc 100:0, UV, KMnO4, PAA)
Wiley ID 1840536