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(E/Z)-2-(Hept-2-en-1-yl)-1-(pyridin-2-yl)-1H-indole
SpectraBase Compound ID 47l7ftc7BVj
InChI InChI=1S/C20H22N2/c1-2-3-4-5-6-12-18-16-17-11-7-8-13-19(17)22(18)20-14-9-10-15-21-20/h5-11,13-16H,2-4,12H2,1H3
InChIKey NVNZDLJPYWAMCD-UHFFFAOYSA-N
Mol Weight 290.41 g/mol
Molecular Formula C20H22N2
Exact Mass 290.178299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FAWZvAWZdo2
Name (E/Z)-2-(Hept-2-en-1-yl)-1-(pyridin-2-yl)-1H-indole
Appearance Colorless oil
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Exact Mass 290.178298716 u
Formula C20H22N2
InChI InChI=1S/C20H22N2/c1-2-3-4-5-6-12-18-16-17-11-7-8-13-19(17)22(18)20-14-9-10-15-21-20/h5-11,13-16H,2-4,12H2,1H3
InChIKey NVNZDLJPYWAMCD-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/anie.201601560
Molecular Weight 290.410 g/mol
Reported Formula C20H22N2
SMILES C(C=CCCCC)C=1N(C2=C(C1)C=CC=C2)C1=NC=CC=C1
SPLASH splash10-014l-0090000000-1e82d6fced89e75f0923
Sample Comments E/Z = 3/1
Source of Spectrum ACI-55-SM25-(E or Z)-5ad (DOI: 10.1002/anie.201601560)
Thin-Layer Chromatography 0.6 (n-hexane/EtOAc, 5:1)
Wiley ID 1904448